AMBER: Fwd: unable to save prmtop/inpcrd for chcl3box

From: Francesco Pietra <chiendarret.yahoo.com>
Date: Fri, 3 Aug 2007 05:24:24 -0700 (PDT)

Please, forget about this message. I had forgot to load parameters for the
solvent (with water it was not a required step).

francesco pietra
--- Francesco Pietra <chiendarret.yahoo.com> wrote:

> Date: Fri, 3 Aug 2007 03:09:03 -0700 (PDT)
> From: Francesco Pietra <chiendarret.yahoo.com>
> Subject: unable to save prmtop/inpcrd for chcl3box
> To: Amber <amber.scripps.edu>
>
> With *.prepin for axial methylcyclohexane, in xleap
>
> solvatebox AME TIP3PBOX 15
>
> worked nicely and tutorial A2 could be completed.
>
> In contrast, with
>
> solvatebox AME CHCL3BOX 15
>
> neither prmtop nor inpcrd were saved (Amber9 in use). In a first attempt
> (leap_old.log, "Could not find type: CL)
>
> A second identical attempt (leap.log) went farther, though one or more atoms
> could not be found. Again neither prmtop nor inpcrd were saved.
>
> I tried
>
> solvatebox AME chcl3box 15
>
> solvatebox: Argument #2 is type String must be type [unit]
>
> chcl3box.off is present in /amber9/dat/leap/lib and all tests were passed
> both
> serial and parallel.
>
> log files attached.
>
> On repeated attempts, unable to detect my mistake. Thanks for help
>
> francesco pietra
>
>
>
>
____________________________________________________________________________________
> Be a better Heartthrob. Get better relationship answers from someone who
> knows. Yahoo! Answers - Check it out.
> http://answers.yahoo.com/dir/?link=list&sid=396545433> log started: Fri Aug
3 11:39:21 2007
>
> Log file: ./leap.log
> > #
> > # ----- leaprc for loading the parm99 additive force field, no lone pairs
> > # assumes that any unspecified nucleic acids are DNA
> > #
> > # load atom type hybridizations
> > #
> > addAtomTypes {
> > { "H" "H" "sp3" }
> > { "HO" "H" "sp3" }
> > { "HS" "H" "sp3" }
> > { "H1" "H" "sp3" }
> > { "H2" "H" "sp3" }
> > { "H3" "H" "sp3" }
> > { "H4" "H" "sp3" }
> > { "H5" "H" "sp3" }
> > { "HW" "H" "sp3" }
> > { "HC" "H" "sp3" }
> > { "HA" "H" "sp3" }
> > { "HP" "H" "sp3" }
> > { "OH" "O" "sp3" }
> > { "OS" "O" "sp3" }
> > { "O" "O" "sp2" }
> > { "O2" "O" "sp2" }
> > { "OW" "O" "sp3" }
> > { "CT" "C" "sp3" }
> > { "CH" "C" "sp3" }
> > { "C2" "C" "sp3" }
> > { "C3" "C" "sp3" }
> > { "C" "C" "sp2" }
> > { "C*" "C" "sp2" }
> > { "CA" "C" "sp2" }
> > { "CB" "C" "sp2" }
> > { "CC" "C" "sp2" }
> > { "CN" "C" "sp2" }
> > { "CM" "C" "sp2" }
> > { "CK" "C" "sp2" }
> > { "CQ" "C" "sp2" }
> > { "CD" "C" "sp2" }
> > { "CE" "C" "sp2" }
> > { "CF" "C" "sp2" }
> > { "CG" "C" "sp2" }
> > { "CP" "C" "sp2" }
> > { "CI" "C" "sp2" }
> > { "CJ" "C" "sp2" }
> > { "CW" "C" "sp2" }
> > { "CV" "C" "sp2" }
> > { "CR" "C" "sp2" }
> > { "CA" "C" "sp2" }
> > { "CY" "C" "sp2" }
> > { "C0" "C" "sp2" }
> > { "MG" "Mg" "sp3" }
> > { "N" "N" "sp2" }
> > { "NA" "N" "sp2" }
> > { "N2" "N" "sp2" }
> > { "N*" "N" "sp2" }
> > { "NP" "N" "sp2" }
> > { "NQ" "N" "sp2" }
> > { "NB" "N" "sp2" }
> > { "NC" "N" "sp2" }
> > { "NT" "N" "sp3" }
> > { "N3" "N" "sp3" }
> > { "S" "S" "sp3" }
> > { "SH" "S" "sp3" }
> > { "P" "P" "sp3" }
> > { "LP" "" "sp3" }
> > { "F" "F" "sp3" }
> > { "CL" "Cl" "sp3" }
> > { "BR" "Br" "sp3" }
> > { "I" "I" "sp3" }
> > { "FE" "Fe" "sp3" }
> > { "EP" "" "sp3" }
> > # glycam
> > { "OG" "O" "sp3" }
> > { "OL" "O" "sp3" }
> > { "AC" "C" "sp3" }
> > { "EC" "C" "sp3" }
> > }
> > #
> > # Load the main parameter set.
> > #
> > parm99 = loadamberparams parm99.dat
> Loading parameters: /usr/local/amber9/dat/leap/parm/parm99.dat
> Reading title:
> PARM99 for DNA,RNA,AA, organic molecules, TIP3P wat. Polariz.& LP
> incl.02/04/99
> (UNKNOWN ATOM TYPE: HZ)
> (UNKNOWN ATOM TYPE: NY)
> (UNKNOWN ATOM TYPE: IM)
> (UNKNOWN ATOM TYPE: Li)
> (UNKNOWN ATOM TYPE: IP)
> (UNKNOWN ATOM TYPE: K)
> (UNKNOWN ATOM TYPE: Rb)
> (UNKNOWN ATOM TYPE: Cs)
> (UNKNOWN ATOM TYPE: Zn)
> (UNKNOWN ATOM TYPE: IB)
> (UNKNOWN ATOM TYPE: LP)
> > #
> > # Load DNA/RNA libraries
> > #
> > loadOff all_nucleic94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_nucleic94.lib
> Loading: DA
> Loading: DA3
> Loading: DA5
> Loading: DAN
> Loading: DC
> Loading: DC3
> Loading: DC5
> Loading: DCN
> Loading: DG
> Loading: DG3
> Loading: DG5
> Loading: DGN
> Loading: DT
> Loading: DT3
> Loading: DT5
> Loading: DTN
> Loading: RA
> Loading: RA3
> Loading: RA5
> Loading: RAN
> Loading: RC
> Loading: RC3
> Loading: RC5
> Loading: RCN
> Loading: RG
> Loading: RG3
> Loading: RG5
> Loading: RGN
> Loading: RU
> Loading: RU3
> Loading: RU5
> Loading: RUN
> > #
> > # Load main chain and terminating
> > # amino acid libraries.
> > #
> > loadOff all_amino94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_amino94.lib
> Loading: ALA
> Loading: ARG
> Loading: ASH
> Loading: ASN
> Loading: ASP
> Loading: CYM
> Loading: CYS
> Loading: CYX
> Loading: GLH
> Loading: GLN
> Loading: GLU
> Loading: GLY
> Loading: HID
> Loading: HIE
> Loading: HIP
> Loading: ILE
> Loading: LEU
> Loading: LYN
> Loading: LYS
> Loading: MET
> Loading: PHE
> Loading: PRO
> Loading: SER
> Loading: THR
> Loading: TRP
> Loading: TYR
> Loading: VAL
> > loadOff all_aminoct94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_aminoct94.lib
> Loading: CALA
> Loading: CARG
> Loading: CASN
> Loading: CASP
> Loading: CCYS
> Loading: CCYX
> Loading: CGLN
> Loading: CGLU
> Loading: CGLY
> Loading: CHID
> Loading: CHIE
> Loading: CHIP
> Loading: CILE
> Loading: CLEU
> Loading: CLYS
> Loading: CMET
> Loading: CPHE
> Loading: CPRO
> Loading: CSER
> Loading: CTHR
> Loading: CTRP
> Loading: CTYR
> Loading: CVAL
> Loading: NHE
> Loading: NME
> > loadOff all_aminont94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_aminont94.lib
> Loading: ACE
> Loading: NALA
> Loading: NARG
> Loading: NASN
> Loading: NASP
> Loading: NCYS
> Loading: NCYX
> Loading: NGLN
> Loading: NGLU
> Loading: NGLY
> Loading: NHID
> Loading: NHIE
> Loading: NHIP
> Loading: NILE
> Loading: NLEU
> Loading: NLYS
> Loading: NMET
> Loading: NPHE
> Loading: NPRO
> Loading: NSER
> Loading: NTHR
> Loading: NTRP
> Loading: NTYR
> Loading: NVAL
> >
> > loadOff ions94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/ions94.lib
> Loading: CIO
> Loading: Cl-
> Loading: Cs+
> Loading: IB
> Loading: K+
> Loading: Li+
> Loading: MG2
> Loading: Na+
> Loading: Rb+
> > loadOff solvents.lib
> Loading library: /usr/local/amber9/dat/leap/lib/solvents.lib
> Loading: CHCL3BOX
> Loading: DC4
> Loading: MEOHBOX
> Loading: NMABOX
> Loading: PL3
> Loading: POL3BOX
> Loading: SPC
> Loading: SPCBOX
> Loading: SPCFWBOX
> Loading: SPF
> Loading: T4E
> Loading: TIP3PBOX
> Loading: TIP4PBOX
> Loading: TIP4PEWBOX
> Loading: TP3
> Loading: TP4
> Loading: TP5
> > HOH = TP3
> > WAT = TP3
> >
> > #
> > # Define the PDB name map for the amino acids and DNA.
> > #
> > addPdbResMap {
> > { 0 "ALA" "NALA" } { 1 "ALA" "CALA" }
> > { 0 "ARG" "NARG" } { 1 "ARG" "CARG" }
> > { 0 "ASN" "NASN" } { 1 "ASN" "CASN" }
> > { 0 "ASP" "NASP" } { 1 "ASP" "CASP" }
> > { 0 "CYS" "NCYS" } { 1 "CYS" "CCYS" }
> > { 0 "CYX" "NCYX" } { 1 "CYX" "CCYX" }
> > { 0 "GLN" "NGLN" } { 1 "GLN" "CGLN" }
> > { 0 "GLU" "NGLU" } { 1 "GLU" "CGLU" }
> > { 0 "GLY" "NGLY" } { 1 "GLY" "CGLY" }
> > { 0 "HID" "NHID" } { 1 "HID" "CHID" }
> > { 0 "HIE" "NHIE" } { 1 "HIE" "CHIE" }
> > { 0 "HIP" "NHIP" } { 1 "HIP" "CHIP" }
> > { 0 "ILE" "NILE" } { 1 "ILE" "CILE" }
> > { 0 "LEU" "NLEU" } { 1 "LEU" "CLEU" }
> > { 0 "LYS" "NLYS" } { 1 "LYS" "CLYS" }
> > { 0 "MET" "NMET" } { 1 "MET" "CMET" }
> > { 0 "PHE" "NPHE" } { 1 "PHE" "CPHE" }
> > { 0 "PRO" "NPRO" } { 1 "PRO" "CPRO" }
> > { 0 "SER" "NSER" } { 1 "SER" "CSER" }
> > { 0 "THR" "NTHR" } { 1 "THR" "CTHR" }
> > { 0 "TRP" "NTRP" } { 1 "TRP" "CTRP" }
> > { 0 "TYR" "NTYR" } { 1 "TYR" "CTYR" }
> > { 0 "VAL" "NVAL" } { 1 "VAL" "CVAL" }
> > { 0 "HIS" "NHIS" } { 1 "HIS" "CHIS" }
> > { 0 "GUA" "DG5" } { 1 "GUA" "DG3" } { "GUA" "DG" }
> > { 0 "ADE" "DA5" } { 1 "ADE" "DA3" } { "ADE" "DA" }
> > { 0 "CYT" "DC5" } { 1 "CYT" "DC3" } { "CYT" "DC" }
> > { 0 "THY" "DT5" } { 1 "THY" "DT3" } { "THY" "DT" }
> > { 0 "G" "DG5" } { 1 "G" "DG3" } { "G" "DG" } { "GN" "DGN" }
> > { 0 "A" "DA5" } { 1 "A" "DA3" } { "A" "DA" } { "AN" "DAN" }
> > { 0 "C" "DC5" } { 1 "C" "DC3" } { "C" "DC" } { "CN" "DCN" }
> > { 0 "T" "DT5" } { 1 "T" "DT3" } { "T" "DT" } { "TN" "DTN" }
> > { 0 "C5" "DC5" }
> > { 0 "G5" "DG5" }
> > { 0 "A5" "DA5" }
> > { 0 "T5" "DT5" }
> > { 1 "C3" "DC3" }
> > { 1 "G3" "DG3" }
> > { 1 "A3" "DA3" }
> > { 1 "T3" "DT3" }
> >
> > }
> >
> > addPdbAtomMap {
> > { "O5*" "O5'" }
> > { "C5*" "C5'" }
> > { "C4*" "C4'" }
> > { "O4*" "O4'" }
> > { "C3*" "C3'" }
> > { "O3*" "O3'" }
> > { "C2*" "C2'" }
> > { "C1*" "C1'" }
> > { "C5M" "C7" }
> > { "H1*" "H1'" }
> > { "H2*1" "H2'1" }
> > { "H2*2" "H2'2" }
> > { "H3*" "H3'" }
> > { "H4*" "H4'" }
> > { "H5*1" "H5'1" }
> > { "H5*2" "H5'2" }
> > # old ff atom names -> new
> > { "O1'" "O4'" }
> > { "OA" "O1P" }
> > { "OB" "O2P" }
> > }
> >
> >
> > #
> > # assumed that most often proteins use HIE
> > #
> > NHIS = NHIE
> > HIS = HIE
> > CHIS = CHIE
>
> > source leaprc.gaff
> ----- Source: /usr/local/amber9/dat/leap/cmd/leaprc.gaff
> ----- Source of /usr/local/amber9/dat/leap/cmd/leaprc.gaff done
> >> logFile leap.log
> log started: Fri Aug 3 11:39:42 2007
>
> Log file: ./leap.log
> >> #
> >> # ----- leaprc for loading the general Amber Force field.
> >> # This file is mostly for use with Antechamber
> >> #
> >> # load atom type hybridizations
> >> #
> >> addAtomTypes {
> >> { "h1" "H" "sp3" }
> >> { "h2" "H" "sp3" }
> >> { "h3" "H" "sp3" }
> >> { "h4" "H" "sp3" }
> >> { "h5" "H" "sp3" }
> >> { "ha" "H" "sp3" }
> >> { "hc" "H" "sp3" }
> >> { "hn" "H" "sp3" }
> >> { "ho" "H" "sp3" }
> >> { "hp" "H" "sp3" }
> >> { "hs" "H" "sp3" }
> >> { "hw" "H" "sp3" }
> >> { "hx" "H" "sp3" }
> >> { "o" "O" "sp2" }
> >> { "o2" "O" "sp2" }
> >> { "oh" "O" "sp3" }
> >> { "os" "O" "sp3" }
> >> { "ow" "O" "sp3" }
> >> { "c" "C" "sp2" }
> >> { "c1" "C" "sp2" }
> >> { "c2" "C" "sp2" }
> >> { "c3" "C" "sp3" }
> >> { "ca" "C" "sp2" }
> >> { "cc" "C" "sp2" }
> >> { "cd" "C" "sp2" }
> >> { "ce" "C" "sp2" }
> >> { "cf" "C" "sp2" }
> >> { "cg" "C" "sp2" }
> >> { "ch" "C" "sp2" }
> >> { "cp" "C" "sp2" }
> >> { "cq" "C" "sp2" }
> >> { "cu" "C" "sp2" }
> >> { "cv" "C" "sp2" }
> >> { "cx" "C" "sp2" }
> >> { "cy" "C" "sp2" }
> >> { "n" "N" "sp2" }
> >> { "n1" "N" "sp2" }
> >> { "n2" "N" "sp2" }
> >> { "n3" "N" "sp3" }
> >> { "n4" "N" "sp3" }
> >> { "na" "N" "sp2" }
> >> { "nb" "N" "sp2" }
> >> { "nc" "N" "sp2" }
> >> { "nd" "N" "sp2" }
> >> { "ne" "N" "sp2" }
> >> { "nf" "N" "sp2" }
> >> { "nh" "N" "sp2" }
> >> { "no" "N" "sp2" }
> >> { "s" "S" "sp2" }
> >> { "s2" "S" "sp2" }
> >> { "s3" "S" "sp3" }
> >> { "s4" "S" "sp3" }
> >> { "s6" "S" "sp3" }
> >> { "sh" "S" "sp3" }
> >> { "ss" "S" "sp3" }
> >> { "sx" "S" "sp3" }
> >> { "sy" "S" "sp3" }
> >> { "p2" "P" "sp2" }
> >> { "p3" "P" "sp3" }
> >> { "p4" "P" "sp3" }
> >> { "p5" "P" "sp3" }
> >> { "pb" "P" "sp3" }
> >> { "pd" "P" "sp3" }
> >> { "px" "P" "sp3" }
> >> { "py" "P" "sp3" }
> >> { "f" "F" "sp3" }
> >> { "cl" "Cl" "sp3" }
> >> { "br" "Br" "sp3" }
> >> { "i" "I" "sp3" }
> >> }
> >> #
> >> # Load the general force field parameter set.
> >> #
> >> gaff = loadamberparams gaff.dat
> Loading parameters: /usr/local/amber9/dat/leap/parm/gaff.dat
> Reading title:
> AMBER General Force Field for organic mol., add. info. at the end (June,
> 2003)
> >
> > loadamberparm ax_mecyclhex.prepin
> ERROR: syntax error
>
> log started: Fri Aug 3 11:41:14 2007
>
> Log file: ./leap.log
> > #
> > # ----- leaprc for loading the parm99 additive force field, no lone pairs
> > # assumes that any unspecified nucleic acids are DNA
> > #
> > # load atom type hybridizations
> > #
> > addAtomTypes {
> > { "H" "H" "sp3" }
> > { "HO" "H" "sp3" }
> > { "HS" "H" "sp3" }
> > { "H1" "H" "sp3" }
> > { "H2" "H" "sp3" }
> > { "H3" "H" "sp3" }
> > { "H4" "H" "sp3" }
> > { "H5" "H" "sp3" }
> > { "HW" "H" "sp3" }
> > { "HC" "H" "sp3" }
> > { "HA" "H" "sp3" }
> > { "HP" "H" "sp3" }
> > { "OH" "O" "sp3" }
> > { "OS" "O" "sp3" }
> > { "O" "O" "sp2" }
> > { "O2" "O" "sp2" }
> > { "OW" "O" "sp3" }
> > { "CT" "C" "sp3" }
> > { "CH" "C" "sp3" }
> > { "C2" "C" "sp3" }
> > { "C3" "C" "sp3" }
> > { "C" "C" "sp2" }
> > { "C*" "C" "sp2" }
> > { "CA" "C" "sp2" }
> > { "CB" "C" "sp2" }
> > { "CC" "C" "sp2" }
> > { "CN" "C" "sp2" }
> > { "CM" "C" "sp2" }
> > { "CK" "C" "sp2" }
> > { "CQ" "C" "sp2" }
> > { "CD" "C" "sp2" }
> > { "CE" "C" "sp2" }
> > { "CF" "C" "sp2" }
> > { "CG" "C" "sp2" }
> > { "CP" "C" "sp2" }
> > { "CI" "C" "sp2" }
> > { "CJ" "C" "sp2" }
> > { "CW" "C" "sp2" }
> > { "CV" "C" "sp2" }
> > { "CR" "C" "sp2" }
> > { "CA" "C" "sp2" }
> > { "CY" "C" "sp2" }
> > { "C0" "C" "sp2" }
> > { "MG" "Mg" "sp3" }
> > { "N" "N" "sp2" }
> > { "NA" "N" "sp2" }
> > { "N2" "N" "sp2" }
> > { "N*" "N" "sp2" }
> > { "NP" "N" "sp2" }
> > { "NQ" "N" "sp2" }
> > { "NB" "N" "sp2" }
> > { "NC" "N" "sp2" }
> > { "NT" "N" "sp3" }
> > { "N3" "N" "sp3" }
> > { "S" "S" "sp3" }
> > { "SH" "S" "sp3" }
> > { "P" "P" "sp3" }
> > { "LP" "" "sp3" }
> > { "F" "F" "sp3" }
> > { "CL" "Cl" "sp3" }
> > { "BR" "Br" "sp3" }
> > { "I" "I" "sp3" }
> > { "FE" "Fe" "sp3" }
> > { "EP" "" "sp3" }
> > # glycam
> > { "OG" "O" "sp3" }
> > { "OL" "O" "sp3" }
> > { "AC" "C" "sp3" }
> > { "EC" "C" "sp3" }
> > }
> > #
> > # Load the main parameter set.
> > #
> > parm99 = loadamberparams parm99.dat
> Loading parameters: /usr/local/amber9/dat/leap/parm/parm99.dat
> Reading title:
> PARM99 for DNA,RNA,AA, organic molecules, TIP3P wat. Polariz.& LP
> incl.02/04/99
> (UNKNOWN ATOM TYPE: HZ)
> (UNKNOWN ATOM TYPE: NY)
> (UNKNOWN ATOM TYPE: IM)
> (UNKNOWN ATOM TYPE: Li)
> (UNKNOWN ATOM TYPE: IP)
> (UNKNOWN ATOM TYPE: K)
> (UNKNOWN ATOM TYPE: Rb)
> (UNKNOWN ATOM TYPE: Cs)
> (UNKNOWN ATOM TYPE: Zn)
> (UNKNOWN ATOM TYPE: IB)
> (UNKNOWN ATOM TYPE: LP)
> > #
> > # Load DNA/RNA libraries
> > #
> > loadOff all_nucleic94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_nucleic94.lib
> Loading: DA
> Loading: DA3
> Loading: DA5
> Loading: DAN
> Loading: DC
> Loading: DC3
> Loading: DC5
> Loading: DCN
> Loading: DG
> Loading: DG3
> Loading: DG5
> Loading: DGN
> Loading: DT
> Loading: DT3
> Loading: DT5
> Loading: DTN
> Loading: RA
> Loading: RA3
> Loading: RA5
> Loading: RAN
> Loading: RC
> Loading: RC3
> Loading: RC5
> Loading: RCN
> Loading: RG
> Loading: RG3
> Loading: RG5
> Loading: RGN
> Loading: RU
> Loading: RU3
> Loading: RU5
> Loading: RUN
> > #
> > # Load main chain and terminating
> > # amino acid libraries.
> > #
> > loadOff all_amino94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_amino94.lib
> Loading: ALA
> Loading: ARG
> Loading: ASH
> Loading: ASN
> Loading: ASP
> Loading: CYM
> Loading: CYS
> Loading: CYX
> Loading: GLH
> Loading: GLN
> Loading: GLU
> Loading: GLY
> Loading: HID
> Loading: HIE
> Loading: HIP
> Loading: ILE
> Loading: LEU
> Loading: LYN
> Loading: LYS
> Loading: MET
> Loading: PHE
> Loading: PRO
> Loading: SER
> Loading: THR
> Loading: TRP
> Loading: TYR
> Loading: VAL
> > loadOff all_aminoct94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_aminoct94.lib
> Loading: CALA
> Loading: CARG
> Loading: CASN
> Loading: CASP
> Loading: CCYS
> Loading: CCYX
> Loading: CGLN
> Loading: CGLU
> Loading: CGLY
> Loading: CHID
> Loading: CHIE
> Loading: CHIP
> Loading: CILE
> Loading: CLEU
> Loading: CLYS
> Loading: CMET
> Loading: CPHE
> Loading: CPRO
> Loading: CSER
> Loading: CTHR
> Loading: CTRP
> Loading: CTYR
> Loading: CVAL
> Loading: NHE
> Loading: NME
> > loadOff all_aminont94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_aminont94.lib
> Loading: ACE
> Loading: NALA
> Loading: NARG
> Loading: NASN
> Loading: NASP
> Loading: NCYS
> Loading: NCYX
> Loading: NGLN
> Loading: NGLU
> Loading: NGLY
> Loading: NHID
> Loading: NHIE
> Loading: NHIP
> Loading: NILE
> Loading: NLEU
> Loading: NLYS
> Loading: NMET
> Loading: NPHE
> Loading: NPRO
> Loading: NSER
> Loading: NTHR
> Loading: NTRP
> Loading: NTYR
> Loading: NVAL
> >
> > loadOff ions94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/ions94.lib
> Loading: CIO
> Loading: Cl-
> Loading: Cs+
> Loading: IB
> Loading: K+
> Loading: Li+
> Loading: MG2
> Loading: Na+
> Loading: Rb+
> > loadOff solvents.lib
> Loading library: /usr/local/amber9/dat/leap/lib/solvents.lib
> Loading: CHCL3BOX
> Loading: DC4
> Loading: MEOHBOX
> Loading: NMABOX
> Loading: PL3
> Loading: POL3BOX
> Loading: SPC
> Loading: SPCBOX
> Loading: SPCFWBOX
> Loading: SPF
> Loading: T4E
> Loading: TIP3PBOX
> Loading: TIP4PBOX
> Loading: TIP4PEWBOX
> Loading: TP3
> Loading: TP4
> Loading: TP5
> > HOH = TP3
> > WAT = TP3
> >
> > #
> > # Define the PDB name map for the amino acids and DNA.
> > #
> > addPdbResMap {
> > { 0 "ALA" "NALA" } { 1 "ALA" "CALA" }
> > { 0 "ARG" "NARG" } { 1 "ARG" "CARG" }
> > { 0 "ASN" "NASN" } { 1 "ASN" "CASN" }
> > { 0 "ASP" "NASP" } { 1 "ASP" "CASP" }
> > { 0 "CYS" "NCYS" } { 1 "CYS" "CCYS" }
> > { 0 "CYX" "NCYX" } { 1 "CYX" "CCYX" }
> > { 0 "GLN" "NGLN" } { 1 "GLN" "CGLN" }
> > { 0 "GLU" "NGLU" } { 1 "GLU" "CGLU" }
> > { 0 "GLY" "NGLY" } { 1 "GLY" "CGLY" }
> > { 0 "HID" "NHID" } { 1 "HID" "CHID" }
> > { 0 "HIE" "NHIE" } { 1 "HIE" "CHIE" }
> > { 0 "HIP" "NHIP" } { 1 "HIP" "CHIP" }
> > { 0 "ILE" "NILE" } { 1 "ILE" "CILE" }
> > { 0 "LEU" "NLEU" } { 1 "LEU" "CLEU" }
> > { 0 "LYS" "NLYS" } { 1 "LYS" "CLYS" }
> > { 0 "MET" "NMET" } { 1 "MET" "CMET" }
> > { 0 "PHE" "NPHE" } { 1 "PHE" "CPHE" }
> > { 0 "PRO" "NPRO" } { 1 "PRO" "CPRO" }
> > { 0 "SER" "NSER" } { 1 "SER" "CSER" }
> > { 0 "THR" "NTHR" } { 1 "THR" "CTHR" }
> > { 0 "TRP" "NTRP" } { 1 "TRP" "CTRP" }
> > { 0 "TYR" "NTYR" } { 1 "TYR" "CTYR" }
> > { 0 "VAL" "NVAL" } { 1 "VAL" "CVAL" }
> > { 0 "HIS" "NHIS" } { 1 "HIS" "CHIS" }
> > { 0 "GUA" "DG5" } { 1 "GUA" "DG3" } { "GUA" "DG" }
> > { 0 "ADE" "DA5" } { 1 "ADE" "DA3" } { "ADE" "DA" }
> > { 0 "CYT" "DC5" } { 1 "CYT" "DC3" } { "CYT" "DC" }
> > { 0 "THY" "DT5" } { 1 "THY" "DT3" } { "THY" "DT" }
> > { 0 "G" "DG5" } { 1 "G" "DG3" } { "G" "DG" } { "GN" "DGN" }
> > { 0 "A" "DA5" } { 1 "A" "DA3" } { "A" "DA" } { "AN" "DAN" }
> > { 0 "C" "DC5" } { 1 "C" "DC3" } { "C" "DC" } { "CN" "DCN" }
> > { 0 "T" "DT5" } { 1 "T" "DT3" } { "T" "DT" } { "TN" "DTN" }
> > { 0 "C5" "DC5" }
> > { 0 "G5" "DG5" }
> > { 0 "A5" "DA5" }
> > { 0 "T5" "DT5" }
> > { 1 "C3" "DC3" }
> > { 1 "G3" "DG3" }
> > { 1 "A3" "DA3" }
> > { 1 "T3" "DT3" }
> >
> > }
> >
> > addPdbAtomMap {
> > { "O5*" "O5'" }
> > { "C5*" "C5'" }
> > { "C4*" "C4'" }
> > { "O4*" "O4'" }
> > { "C3*" "C3'" }
> > { "O3*" "O3'" }
> > { "C2*" "C2'" }
> > { "C1*" "C1'" }
> > { "C5M" "C7" }
> > { "H1*" "H1'" }
> > { "H2*1" "H2'1" }
> > { "H2*2" "H2'2" }
> > { "H3*" "H3'" }
> > { "H4*" "H4'" }
> > { "H5*1" "H5'1" }
> > { "H5*2" "H5'2" }
> > # old ff atom names -> new
> > { "O1'" "O4'" }
> > { "OA" "O1P" }
> > { "OB" "O2P" }
> > }
> >
> >
> > #
> > # assumed that most often proteins use HIE
> > #
> > NHIS = NHIE
> > HIS = HIE
> > CHIS = CHIE
>
> > source leaprc.gaff
> ----- Source: /usr/local/amber9/dat/leap/cmd/leaprc.gaff
> ----- Source of /usr/local/amber9/dat/leap/cmd/leaprc.gaff done
> >> logFile leap.log
> log started: Fri Aug 3 11:41:31 2007
>
> Log file: ./leap.log
> >> #
> >> # ----- leaprc for loading the general Amber Force field.
> >> # This file is mostly for use with Antechamber
> >> #
> >> # load atom type hybridizations
> >> #
> >> addAtomTypes {
> >> { "h1" "H" "sp3" }
> >> { "h2" "H" "sp3" }
> >> { "h3" "H" "sp3" }
> >> { "h4" "H" "sp3" }
> >> { "h5" "H" "sp3" }
> >> { "ha" "H" "sp3" }
> >> { "hc" "H" "sp3" }
> >> { "hn" "H" "sp3" }
> >> { "ho" "H" "sp3" }
> >> { "hp" "H" "sp3" }
> >> { "hs" "H" "sp3" }
> >> { "hw" "H" "sp3" }
> >> { "hx" "H" "sp3" }
> >> { "o" "O" "sp2" }
> >> { "o2" "O" "sp2" }
> >> { "oh" "O" "sp3" }
> >> { "os" "O" "sp3" }
> >> { "ow" "O" "sp3" }
> >> { "c" "C" "sp2" }
> >> { "c1" "C" "sp2" }
> >> { "c2" "C" "sp2" }
> >> { "c3" "C" "sp3" }
> >> { "ca" "C" "sp2" }
> >> { "cc" "C" "sp2" }
> >> { "cd" "C" "sp2" }
> >> { "ce" "C" "sp2" }
> >> { "cf" "C" "sp2" }
> >> { "cg" "C" "sp2" }
> >> { "ch" "C" "sp2" }
> >> { "cp" "C" "sp2" }
> >> { "cq" "C" "sp2" }
> >> { "cu" "C" "sp2" }
> >> { "cv" "C" "sp2" }
> >> { "cx" "C" "sp2" }
> >> { "cy" "C" "sp2" }
> >> { "n" "N" "sp2" }
> >> { "n1" "N" "sp2" }
> >> { "n2" "N" "sp2" }
> >> { "n3" "N" "sp3" }
> >> { "n4" "N" "sp3" }
> >> { "na" "N" "sp2" }
> >> { "nb" "N" "sp2" }
> >> { "nc" "N" "sp2" }
> >> { "nd" "N" "sp2" }
> >> { "ne" "N" "sp2" }
> >> { "nf" "N" "sp2" }
> >> { "nh" "N" "sp2" }
> >> { "no" "N" "sp2" }
> >> { "s" "S" "sp2" }
> >> { "s2" "S" "sp2" }
> >> { "s3" "S" "sp3" }
> >> { "s4" "S" "sp3" }
> >> { "s6" "S" "sp3" }
> >> { "sh" "S" "sp3" }
> >> { "ss" "S" "sp3" }
> >> { "sx" "S" "sp3" }
> >> { "sy" "S" "sp3" }
> >> { "p2" "P" "sp2" }
> >> { "p3" "P" "sp3" }
> >> { "p4" "P" "sp3" }
> >> { "p5" "P" "sp3" }
> >> { "pb" "P" "sp3" }
> >> { "pd" "P" "sp3" }
> >> { "px" "P" "sp3" }
> >> { "py" "P" "sp3" }
> >> { "f" "F" "sp3" }
> >> { "cl" "Cl" "sp3" }
> >> { "br" "Br" "sp3" }
> >> { "i" "I" "sp3" }
> >> }
> >> #
> >> # Load the general force field parameter set.
> >> #
> >> gaff = loadamberparams gaff.dat
> Loading parameters: /usr/local/amber9/dat/leap/parm/gaff.dat
> Reading title:
> AMBER General Force Field for organic mol., add. info. at the end (June,
> 2003)
> >
> > loadamberprep ax_mecyclhex.prepin
> Loading Prep file: ./ax_mecyclhex.prepin
> Loaded UNIT: AME
> > check AME
> Checking 'AME'....
> Checking parameters for unit 'AME'.
> Checking for bond parameters.
> Checking for angle parameters.
> Unit is OK.
> > solvatebox AME chcl3box 15
> solvateBox: Argument #2 is type String must be of type: [unit]
> usage: solvateBox <solute> <solvent> <buffer> [iso] [closeness]
> > solvateBox AME chcl3box 15
> solvateBox: Argument #2 is type String must be of type: [unit]
> usage: solvateBox <solute> <solvent> <buffer> [iso] [closeness]
> > solvatebox AME CHCL3BOX 15
> Solute vdw bounding box: 7.563 7.914 6.786
> Total bounding box for atom centers: 37.563 37.914 36.786
> Solvent unit box: 56.496 56.496 56.496
> The number of boxes: x= 1 y= 1 z= 1
> Adding box at: x=0 y=0 z=0
> Center of solvent box is: 0.000000, 0.000000, 0.000000
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
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> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
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> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
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> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> Total vdw box size: 40.349 40.825 39.450 angstroms.
> Volume: 64983.931 A^3
> Mass > 4368.086 amu, Density > 0.112 g/cc
> (type - hence mass - of one or more atoms could not be found)
> Added 328 residues.
> > log started: Fri Aug 3 11:18:56 2007
>
> Log file: ./leap.log
> > #
> > # ----- leaprc for loading the parm99 additive force field, no lone pairs
> > # assumes that any unspecified nucleic acids are DNA
> > #
> > # load atom type hybridizations
> > #
> > addAtomTypes {
> > { "H" "H" "sp3" }
> > { "HO" "H" "sp3" }
> > { "HS" "H" "sp3" }
> > { "H1" "H" "sp3" }
> > { "H2" "H" "sp3" }
> > { "H3" "H" "sp3" }
> > { "H4" "H" "sp3" }
> > { "H5" "H" "sp3" }
> > { "HW" "H" "sp3" }
> > { "HC" "H" "sp3" }
> > { "HA" "H" "sp3" }
> > { "HP" "H" "sp3" }
> > { "OH" "O" "sp3" }
> > { "OS" "O" "sp3" }
> > { "O" "O" "sp2" }
> > { "O2" "O" "sp2" }
> > { "OW" "O" "sp3" }
> > { "CT" "C" "sp3" }
> > { "CH" "C" "sp3" }
> > { "C2" "C" "sp3" }
> > { "C3" "C" "sp3" }
> > { "C" "C" "sp2" }
> > { "C*" "C" "sp2" }
> > { "CA" "C" "sp2" }
> > { "CB" "C" "sp2" }
> > { "CC" "C" "sp2" }
> > { "CN" "C" "sp2" }
> > { "CM" "C" "sp2" }
> > { "CK" "C" "sp2" }
> > { "CQ" "C" "sp2" }
> > { "CD" "C" "sp2" }
> > { "CE" "C" "sp2" }
> > { "CF" "C" "sp2" }
> > { "CG" "C" "sp2" }
> > { "CP" "C" "sp2" }
> > { "CI" "C" "sp2" }
> > { "CJ" "C" "sp2" }
> > { "CW" "C" "sp2" }
> > { "CV" "C" "sp2" }
> > { "CR" "C" "sp2" }
> > { "CA" "C" "sp2" }
> > { "CY" "C" "sp2" }
> > { "C0" "C" "sp2" }
> > { "MG" "Mg" "sp3" }
> > { "N" "N" "sp2" }
> > { "NA" "N" "sp2" }
> > { "N2" "N" "sp2" }
> > { "N*" "N" "sp2" }
> > { "NP" "N" "sp2" }
> > { "NQ" "N" "sp2" }
> > { "NB" "N" "sp2" }
> > { "NC" "N" "sp2" }
> > { "NT" "N" "sp3" }
> > { "N3" "N" "sp3" }
> > { "S" "S" "sp3" }
> > { "SH" "S" "sp3" }
> > { "P" "P" "sp3" }
> > { "LP" "" "sp3" }
> > { "F" "F" "sp3" }
> > { "CL" "Cl" "sp3" }
> > { "BR" "Br" "sp3" }
> > { "I" "I" "sp3" }
> > { "FE" "Fe" "sp3" }
> > { "EP" "" "sp3" }
> > # glycam
> > { "OG" "O" "sp3" }
> > { "OL" "O" "sp3" }
> > { "AC" "C" "sp3" }
> > { "EC" "C" "sp3" }
> > }
> > #
> > # Load the main parameter set.
> > #
> > parm99 = loadamberparams parm99.dat
> Loading parameters: /usr/local/amber9/dat/leap/parm/parm99.dat
> Reading title:
> PARM99 for DNA,RNA,AA, organic molecules, TIP3P wat. Polariz.& LP
> incl.02/04/99
> (UNKNOWN ATOM TYPE: HZ)
> (UNKNOWN ATOM TYPE: NY)
> (UNKNOWN ATOM TYPE: IM)
> (UNKNOWN ATOM TYPE: Li)
> (UNKNOWN ATOM TYPE: IP)
> (UNKNOWN ATOM TYPE: K)
> (UNKNOWN ATOM TYPE: Rb)
> (UNKNOWN ATOM TYPE: Cs)
> (UNKNOWN ATOM TYPE: Zn)
> (UNKNOWN ATOM TYPE: IB)
> (UNKNOWN ATOM TYPE: LP)
> > #
> > # Load DNA/RNA libraries
> > #
> > loadOff all_nucleic94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_nucleic94.lib
> Loading: DA
> Loading: DA3
> Loading: DA5
> Loading: DAN
> Loading: DC
> Loading: DC3
> Loading: DC5
> Loading: DCN
> Loading: DG
> Loading: DG3
> Loading: DG5
> Loading: DGN
> Loading: DT
> Loading: DT3
> Loading: DT5
> Loading: DTN
> Loading: RA
> Loading: RA3
> Loading: RA5
> Loading: RAN
> Loading: RC
> Loading: RC3
> Loading: RC5
> Loading: RCN
> Loading: RG
> Loading: RG3
> Loading: RG5
> Loading: RGN
> Loading: RU
> Loading: RU3
> Loading: RU5
> Loading: RUN
> > #
> > # Load main chain and terminating
> > # amino acid libraries.
> > #
> > loadOff all_amino94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_amino94.lib
> Loading: ALA
> Loading: ARG
> Loading: ASH
> Loading: ASN
> Loading: ASP
> Loading: CYM
> Loading: CYS
> Loading: CYX
> Loading: GLH
> Loading: GLN
> Loading: GLU
> Loading: GLY
> Loading: HID
> Loading: HIE
> Loading: HIP
> Loading: ILE
> Loading: LEU
> Loading: LYN
> Loading: LYS
> Loading: MET
> Loading: PHE
> Loading: PRO
> Loading: SER
> Loading: THR
> Loading: TRP
> Loading: TYR
> Loading: VAL
> > loadOff all_aminoct94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_aminoct94.lib
> Loading: CALA
> Loading: CARG
> Loading: CASN
> Loading: CASP
> Loading: CCYS
> Loading: CCYX
> Loading: CGLN
> Loading: CGLU
> Loading: CGLY
> Loading: CHID
> Loading: CHIE
> Loading: CHIP
> Loading: CILE
> Loading: CLEU
> Loading: CLYS
> Loading: CMET
> Loading: CPHE
> Loading: CPRO
> Loading: CSER
> Loading: CTHR
> Loading: CTRP
> Loading: CTYR
> Loading: CVAL
> Loading: NHE
> Loading: NME
> > loadOff all_aminont94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/all_aminont94.lib
> Loading: ACE
> Loading: NALA
> Loading: NARG
> Loading: NASN
> Loading: NASP
> Loading: NCYS
> Loading: NCYX
> Loading: NGLN
> Loading: NGLU
> Loading: NGLY
> Loading: NHID
> Loading: NHIE
> Loading: NHIP
> Loading: NILE
> Loading: NLEU
> Loading: NLYS
> Loading: NMET
> Loading: NPHE
> Loading: NPRO
> Loading: NSER
> Loading: NTHR
> Loading: NTRP
> Loading: NTYR
> Loading: NVAL
> >
> > loadOff ions94.lib
> Loading library: /usr/local/amber9/dat/leap/lib/ions94.lib
> Loading: CIO
> Loading: Cl-
> Loading: Cs+
> Loading: IB
> Loading: K+
> Loading: Li+
> Loading: MG2
> Loading: Na+
> Loading: Rb+
> > loadOff solvents.lib
> Loading library: /usr/local/amber9/dat/leap/lib/solvents.lib
> Loading: CHCL3BOX
> Loading: DC4
> Loading: MEOHBOX
> Loading: NMABOX
> Loading: PL3
> Loading: POL3BOX
> Loading: SPC
> Loading: SPCBOX
> Loading: SPCFWBOX
> Loading: SPF
> Loading: T4E
> Loading: TIP3PBOX
> Loading: TIP4PBOX
> Loading: TIP4PEWBOX
> Loading: TP3
> Loading: TP4
> Loading: TP5
> > HOH = TP3
> > WAT = TP3
> >
> > #
> > # Define the PDB name map for the amino acids and DNA.
> > #
> > addPdbResMap {
> > { 0 "ALA" "NALA" } { 1 "ALA" "CALA" }
> > { 0 "ARG" "NARG" } { 1 "ARG" "CARG" }
> > { 0 "ASN" "NASN" } { 1 "ASN" "CASN" }
> > { 0 "ASP" "NASP" } { 1 "ASP" "CASP" }
> > { 0 "CYS" "NCYS" } { 1 "CYS" "CCYS" }
> > { 0 "CYX" "NCYX" } { 1 "CYX" "CCYX" }
> > { 0 "GLN" "NGLN" } { 1 "GLN" "CGLN" }
> > { 0 "GLU" "NGLU" } { 1 "GLU" "CGLU" }
> > { 0 "GLY" "NGLY" } { 1 "GLY" "CGLY" }
> > { 0 "HID" "NHID" } { 1 "HID" "CHID" }
> > { 0 "HIE" "NHIE" } { 1 "HIE" "CHIE" }
> > { 0 "HIP" "NHIP" } { 1 "HIP" "CHIP" }
> > { 0 "ILE" "NILE" } { 1 "ILE" "CILE" }
> > { 0 "LEU" "NLEU" } { 1 "LEU" "CLEU" }
> > { 0 "LYS" "NLYS" } { 1 "LYS" "CLYS" }
> > { 0 "MET" "NMET" } { 1 "MET" "CMET" }
> > { 0 "PHE" "NPHE" } { 1 "PHE" "CPHE" }
> > { 0 "PRO" "NPRO" } { 1 "PRO" "CPRO" }
> > { 0 "SER" "NSER" } { 1 "SER" "CSER" }
> > { 0 "THR" "NTHR" } { 1 "THR" "CTHR" }
> > { 0 "TRP" "NTRP" } { 1 "TRP" "CTRP" }
> > { 0 "TYR" "NTYR" } { 1 "TYR" "CTYR" }
> > { 0 "VAL" "NVAL" } { 1 "VAL" "CVAL" }
> > { 0 "HIS" "NHIS" } { 1 "HIS" "CHIS" }
> > { 0 "GUA" "DG5" } { 1 "GUA" "DG3" } { "GUA" "DG" }
> > { 0 "ADE" "DA5" } { 1 "ADE" "DA3" } { "ADE" "DA" }
> > { 0 "CYT" "DC5" } { 1 "CYT" "DC3" } { "CYT" "DC" }
> > { 0 "THY" "DT5" } { 1 "THY" "DT3" } { "THY" "DT" }
> > { 0 "G" "DG5" } { 1 "G" "DG3" } { "G" "DG" } { "GN" "DGN" }
> > { 0 "A" "DA5" } { 1 "A" "DA3" } { "A" "DA" } { "AN" "DAN" }
> > { 0 "C" "DC5" } { 1 "C" "DC3" } { "C" "DC" } { "CN" "DCN" }
> > { 0 "T" "DT5" } { 1 "T" "DT3" } { "T" "DT" } { "TN" "DTN" }
> > { 0 "C5" "DC5" }
> > { 0 "G5" "DG5" }
> > { 0 "A5" "DA5" }
> > { 0 "T5" "DT5" }
> > { 1 "C3" "DC3" }
> > { 1 "G3" "DG3" }
> > { 1 "A3" "DA3" }
> > { 1 "T3" "DT3" }
> >
> > }
> >
> > addPdbAtomMap {
> > { "O5*" "O5'" }
> > { "C5*" "C5'" }
> > { "C4*" "C4'" }
> > { "O4*" "O4'" }
> > { "C3*" "C3'" }
> > { "O3*" "O3'" }
> > { "C2*" "C2'" }
> > { "C1*" "C1'" }
> > { "C5M" "C7" }
> > { "H1*" "H1'" }
> > { "H2*1" "H2'1" }
> > { "H2*2" "H2'2" }
> > { "H3*" "H3'" }
> > { "H4*" "H4'" }
> > { "H5*1" "H5'1" }
> > { "H5*2" "H5'2" }
> > # old ff atom names -> new
> > { "O1'" "O4'" }
> > { "OA" "O1P" }
> > { "OB" "O2P" }
> > }
> >
> >
> > #
> > # assumed that most often proteins use HIE
> > #
> > NHIS = NHIE
> > HIS = HIE
> > CHIS = CHIE
>
> > source leaprc.gaff
> ----- Source: /usr/local/amber9/dat/leap/cmd/leaprc.gaff
> ----- Source of /usr/local/amber9/dat/leap/cmd/leaprc.gaff done
> >> logFile leap.log
> log started: Fri Aug 3 11:19:27 2007
>
> Log file: ./leap.log
> >> #
> >> # ----- leaprc for loading the general Amber Force field.
> >> # This file is mostly for use with Antechamber
> >> #
> >> # load atom type hybridizations
> >> #
> >> addAtomTypes {
> >> { "h1" "H" "sp3" }
> >> { "h2" "H" "sp3" }
> >> { "h3" "H" "sp3" }
> >> { "h4" "H" "sp3" }
> >> { "h5" "H" "sp3" }
> >> { "ha" "H" "sp3" }
> >> { "hc" "H" "sp3" }
> >> { "hn" "H" "sp3" }
> >> { "ho" "H" "sp3" }
> >> { "hp" "H" "sp3" }
> >> { "hs" "H" "sp3" }
> >> { "hw" "H" "sp3" }
> >> { "hx" "H" "sp3" }
> >> { "o" "O" "sp2" }
> >> { "o2" "O" "sp2" }
> >> { "oh" "O" "sp3" }
> >> { "os" "O" "sp3" }
> >> { "ow" "O" "sp3" }
> >> { "c" "C" "sp2" }
> >> { "c1" "C" "sp2" }
> >> { "c2" "C" "sp2" }
> >> { "c3" "C" "sp3" }
> >> { "ca" "C" "sp2" }
> >> { "cc" "C" "sp2" }
> >> { "cd" "C" "sp2" }
> >> { "ce" "C" "sp2" }
> >> { "cf" "C" "sp2" }
> >> { "cg" "C" "sp2" }
> >> { "ch" "C" "sp2" }
> >> { "cp" "C" "sp2" }
> >> { "cq" "C" "sp2" }
> >> { "cu" "C" "sp2" }
> >> { "cv" "C" "sp2" }
> >> { "cx" "C" "sp2" }
> >> { "cy" "C" "sp2" }
> >> { "n" "N" "sp2" }
> >> { "n1" "N" "sp2" }
> >> { "n2" "N" "sp2" }
> >> { "n3" "N" "sp3" }
> >> { "n4" "N" "sp3" }
> >> { "na" "N" "sp2" }
> >> { "nb" "N" "sp2" }
> >> { "nc" "N" "sp2" }
> >> { "nd" "N" "sp2" }
> >> { "ne" "N" "sp2" }
> >> { "nf" "N" "sp2" }
> >> { "nh" "N" "sp2" }
> >> { "no" "N" "sp2" }
> >> { "s" "S" "sp2" }
> >> { "s2" "S" "sp2" }
> >> { "s3" "S" "sp3" }
> >> { "s4" "S" "sp3" }
> >> { "s6" "S" "sp3" }
> >> { "sh" "S" "sp3" }
> >> { "ss" "S" "sp3" }
> >> { "sx" "S" "sp3" }
> >> { "sy" "S" "sp3" }
> >> { "p2" "P" "sp2" }
> >> { "p3" "P" "sp3" }
> >> { "p4" "P" "sp3" }
> >> { "p5" "P" "sp3" }
> >> { "pb" "P" "sp3" }
> >> { "pd" "P" "sp3" }
> >> { "px" "P" "sp3" }
> >> { "py" "P" "sp3" }
> >> { "f" "F" "sp3" }
> >> { "cl" "Cl" "sp3" }
> >> { "br" "Br" "sp3" }
> >> { "i" "I" "sp3" }
> >> }
> >> #
> >> # Load the general force field parameter set.
> >> #
> >> gaff = loadamberparams gaff.dat
> Loading parameters: /usr/local/amber9/dat/leap/parm/gaff.dat
> Reading title:
> AMBER General Force Field for organic mol., add. info. at the end (June,
> 2003)
> >
> > loadamberprep ax_mecyclhex.prepin
> Loading Prep file: ./ax_mecyclhex.prepin
> Loaded UNIT: AME
> > check AME
> Checking 'AME'....
> Checking parameters for unit 'AME'.
> Checking for bond parameters.
> Checking for angle parameters.
> Unit is OK.
> > solvatebox AME chcl3box 15
> solvateBox: Argument #2 is type String must be of type: [unit]
> usage: solvateBox <solute> <solvent> <buffer> [iso] [closeness]
> > solvatebox AME CHCL3BOX 15
> Solute vdw bounding box: 7.563 7.914 6.786
> Total bounding box for atom centers: 37.563 37.914 36.786
> Solvent unit box: 56.496 56.496 56.496
> The number of boxes: x= 1 y= 1 z= 1
> Adding box at: x=0 y=0 z=0
> Center of solvent box is: 0.000000, 0.000000, 0.000000
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> (using default radius 1.500000 for CL1)
> (using default radius 1.500000 for CL2)
> (using default radius 1.500000 for CL3)
> Total vdw box size: 40.349 40.825 39.450 angstroms.
> Volume: 64983.931 A^3
> Mass > 4368.086 amu, Density > 0.112 g/cc
> (type - hence mass - of one or more atoms could not be found)
> Added 328 residues.
> > saveamberparm AME ax_mecyclhex_chcl3.prmtop ax_mecyclhex_chcl3.inpcrd
> Checking Unit.
> Building topology.
> Building atom parameters.
> For atom: .R<CL3 2>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 2>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 2>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 3>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 3>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 3>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 4>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 4>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 4>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 5>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 5>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 5>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 6>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 6>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 6>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 7>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 7>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 7>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 8>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 8>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 8>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 9>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 9>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 9>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 10>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 10>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 10>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 11>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 11>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 11>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 12>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 12>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 12>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 13>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 13>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 13>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 14>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 14>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 14>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 15>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 15>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 15>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 16>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 16>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 16>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 17>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 17>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 17>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 18>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 18>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 18>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 19>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 19>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 19>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 20>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 20>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 20>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 21>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 21>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 21>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 22>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 22>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 22>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 23>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 23>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 23>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 24>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 24>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 24>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 25>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 25>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 25>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 26>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 26>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 26>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 27>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 27>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 27>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 28>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 28>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 28>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 29>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 29>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 29>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 30>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 30>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 30>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 31>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 31>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 31>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 32>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 32>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 32>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 33>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 33>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 33>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 34>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 34>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 34>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 35>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 35>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 35>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 36>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 36>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 36>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 37>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 37>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 37>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 38>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 38>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 38>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 39>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 39>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 39>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 40>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 40>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 40>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 41>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 41>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 41>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 42>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 42>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 42>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 43>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 43>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 43>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 44>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 44>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 44>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 45>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 45>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 45>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 46>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 46>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 46>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 47>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 47>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 47>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 48>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 48>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 48>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 49>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 49>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 49>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 50>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 50>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 50>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 51>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 51>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 51>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 52>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 52>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 52>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 53>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 53>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 53>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 54>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 54>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 54>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 55>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 55>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 55>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 56>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 56>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 56>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 57>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 57>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 57>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 58>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 58>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 58>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 59>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 59>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 59>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 60>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 60>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 60>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 61>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 61>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 61>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 62>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 62>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 62>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 63>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 63>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 63>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 64>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 64>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 64>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 65>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 65>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 65>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 66>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 66>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 66>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 67>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 67>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 67>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 68>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 68>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 68>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 69>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 69>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 69>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 70>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 70>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 70>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 71>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 71>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 71>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 72>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 72>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 72>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 73>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 73>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 73>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 74>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 74>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 74>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 75>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 75>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 75>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 76>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 76>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 76>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 77>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 77>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 77>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 78>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 78>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 78>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 79>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 79>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 79>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 80>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 80>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 80>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 81>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 81>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 81>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 82>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 82>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 82>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 83>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 83>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 83>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 84>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 84>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 84>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 85>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 85>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 85>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 86>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 86>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 86>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 87>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 87>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 87>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 88>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 88>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 88>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 89>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 89>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 89>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 90>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 90>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 90>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 91>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 91>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 91>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 92>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 92>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 92>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 93>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 93>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 93>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 94>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 94>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 94>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 95>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 95>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 95>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 96>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 96>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 96>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 97>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 97>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 97>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 98>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 98>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 98>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 99>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 99>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 99>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 100>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 100>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 100>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 101>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 101>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 101>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 102>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 102>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 102>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 103>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 103>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 103>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 104>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 104>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 104>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 105>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 105>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 105>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 106>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 106>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 106>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 107>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 107>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 107>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 108>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 108>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 108>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 109>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 109>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 109>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 110>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 110>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 110>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 111>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 111>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 111>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 112>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 112>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 112>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 113>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 113>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 113>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 114>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 114>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 114>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 115>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 115>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 115>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 116>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 116>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 116>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 117>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 117>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 117>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 118>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 118>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 118>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 119>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 119>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 119>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 120>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 120>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 120>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 121>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 121>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 121>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 122>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 122>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 122>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 123>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 123>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 123>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 124>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 124>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 124>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 125>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 125>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 125>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 126>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 126>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 126>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 127>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 127>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 127>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 128>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 128>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 128>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 129>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 129>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 129>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 130>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 130>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 130>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 131>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 131>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 131>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 132>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 132>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 132>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 133>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 133>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 133>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 134>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 134>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 134>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 135>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 135>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 135>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 136>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 136>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 136>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 137>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 137>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 137>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 138>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 138>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 138>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 139>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 139>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 139>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 140>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 140>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 140>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 141>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 141>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 141>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 142>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 142>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 142>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 143>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 143>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 143>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 144>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 144>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 144>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 145>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 145>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 145>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 146>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 146>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 146>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 147>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 147>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 147>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 148>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 148>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 148>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 149>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 149>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 149>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 150>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 150>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 150>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 151>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 151>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 151>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 152>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 152>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 152>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 153>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 153>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 153>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 154>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 154>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 154>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 155>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 155>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 155>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 156>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 156>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 156>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 157>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 157>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 157>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 158>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 158>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 158>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 159>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 159>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 159>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 160>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 160>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 160>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 161>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 161>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 161>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 162>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 162>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 162>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 163>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 163>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 163>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 164>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 164>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 164>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 165>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 165>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 165>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 166>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 166>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 166>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 167>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 167>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 167>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 168>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 168>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 168>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 169>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 169>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 169>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 170>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 170>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 170>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 171>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 171>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 171>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 172>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 172>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 172>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 173>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 173>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 173>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 174>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 174>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 174>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 175>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 175>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 175>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 176>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 176>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 176>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 177>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 177>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 177>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 178>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 178>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 178>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 179>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 179>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 179>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 180>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 180>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 180>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 181>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 181>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 181>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 182>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 182>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 182>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 183>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 183>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 183>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 184>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 184>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 184>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 185>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 185>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 185>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 186>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 186>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 186>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 187>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 187>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 187>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 188>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 188>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 188>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 189>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 189>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 189>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 190>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 190>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 190>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 191>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 191>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 191>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 192>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 192>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 192>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 193>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 193>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 193>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 194>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 194>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 194>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 195>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 195>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 195>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 196>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 196>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 196>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 197>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 197>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 197>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 198>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 198>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 198>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 199>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 199>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 199>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 200>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 200>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 200>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 201>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 201>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 201>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 202>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 202>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 202>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 203>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 203>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 203>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 204>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 204>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 204>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 205>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 205>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 205>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 206>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 206>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 206>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 207>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 207>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 207>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 208>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 208>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 208>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 209>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 209>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 209>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 210>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 210>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 210>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 211>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 211>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 211>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 212>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 212>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 212>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 213>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 213>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 213>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 214>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 214>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 214>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 215>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 215>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 215>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 216>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 216>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 216>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 217>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 217>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 217>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 218>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 218>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 218>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 219>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 219>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 219>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 220>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 220>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 220>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 221>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 221>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 221>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 222>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 222>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 222>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 223>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 223>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 223>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 224>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 224>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 224>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 225>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 225>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 225>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 226>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 226>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 226>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 227>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 227>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 227>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 228>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 228>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 228>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 229>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 229>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 229>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 230>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 230>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 230>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 231>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 231>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 231>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 232>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 232>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 232>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 233>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 233>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 233>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 234>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 234>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 234>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 235>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 235>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 235>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 236>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 236>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 236>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 237>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 237>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 237>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 238>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 238>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 238>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 239>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 239>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 239>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 240>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 240>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 240>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 241>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 241>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 241>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 242>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 242>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 242>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 243>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 243>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 243>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 244>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 244>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 244>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 245>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 245>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 245>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 246>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 246>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 246>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 247>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 247>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 247>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 248>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 248>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 248>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 249>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 249>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 249>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 250>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 250>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 250>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 251>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 251>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 251>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 252>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 252>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 252>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 253>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 253>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 253>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 254>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 254>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 254>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 255>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 255>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 255>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 256>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 256>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 256>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 257>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 257>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 257>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 258>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 258>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 258>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 259>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 259>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 259>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 260>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 260>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 260>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 261>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 261>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 261>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 262>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 262>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 262>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 263>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 263>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 263>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 264>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 264>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 264>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 265>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 265>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 265>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 266>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 266>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 266>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 267>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 267>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 267>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 268>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 268>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 268>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 269>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 269>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 269>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 270>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 270>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 270>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 271>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 271>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 271>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 272>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 272>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 272>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 273>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 273>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 273>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 274>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 274>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 274>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 275>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 275>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 275>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 276>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 276>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 276>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 277>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 277>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 277>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 278>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 278>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 278>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 279>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 279>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 279>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 280>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 280>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 280>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 281>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 281>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 281>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 282>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 282>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 282>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 283>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 283>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 283>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 284>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 284>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 284>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 285>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 285>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 285>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 286>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 286>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 286>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 287>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 287>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 287>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 288>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 288>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 288>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 289>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 289>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 289>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 290>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 290>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 290>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 291>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 291>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 291>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 292>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 292>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 292>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 293>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 293>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 293>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 294>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 294>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 294>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 295>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 295>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 295>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 296>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 296>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 296>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 297>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 297>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 297>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 298>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 298>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 298>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 299>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 299>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 299>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 300>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 300>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 300>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 301>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 301>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 301>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 302>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 302>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 302>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 303>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 303>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 303>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 304>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 304>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 304>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 305>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 305>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 305>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 306>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 306>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 306>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 307>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 307>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 307>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 308>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 308>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 308>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 309>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 309>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 309>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 310>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 310>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 310>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 311>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 311>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 311>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 312>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 312>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 312>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 313>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 313>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 313>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 314>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 314>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 314>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 315>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 315>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 315>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 316>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 316>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 316>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 317>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 317>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 317>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 318>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 318>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 318>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 319>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 319>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 319>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 320>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 320>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 320>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 321>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 321>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 321>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 322>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 322>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 322>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 323>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 323>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 323>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 324>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 324>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 324>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 325>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 325>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 325>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 326>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 326>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 326>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 327>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 327>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 327>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 328>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 328>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 328>.A<CL3 5> Could not find type: CL
> For atom: .R<CL3 329>.A<CL1 3> Could not find type: CL
> For atom: .R<CL3 329>.A<CL2 4> Could not find type: CL
> For atom: .R<CL3 329>.A<CL3 5> Could not find type: CL
> Parameter file was not saved.
>



       
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Received on Sun Aug 05 2007 - 06:07:50 PDT