=>> Init data Presuming executables of amber suite to be in /home/xtal/amber_10_install/exe =>> Reading input parameters Found PREFIX => 20-snaps Found PATH => ./ Found COMPLEX => 1 Found RECEPTOR => 1 Found LIGAND => 1 Found COMPT => ./complex.prmtop Found RECPT => ./receptor.prmtop Found LIGPT => ./ligand.prmtop Found GC => 1 Found AS => 0 Found DC => 0 Found MM => 0 Found GB => 0 Found PB => 0 Found MS => 0 Found NM => 0 Found BOX => YES Found NTOTAL => 7371 Found NSTART => 1 Found NSTOP => 20 Found NFREQ => 1 Found NUMBER_LIG_GROUPS => 1 Found LSTART => 6798 Found LSTOP => 6846 Found NUMBER_REC_GROUPS => 2 Found RSTART => 1 Found RSTOP => 6797 Found RSTART => 6847 Found RSTOP => 7371 Found TRAJECTORY => ./prod1.mdcrd Found TRAJECTORY => ./prod2.mdcrd Found TRAJECTORY => ./prod3.mdcrd Found TRAJECTORY => ./prod4.mdcrd =>> Checking sanity Checking GENERAL Setting START to default 1 Setting STOP to default 10e10 Setting OFFSET to default 1 Setting VERBOSE to default 0 Checking GC Checking TRAJ =>> Creating input make_crd input =>> Creating coordinates Executing makecrd Amber8 Module: make_crg_hg usage: make_crd_hg < trajectory_file Box info found: 42.3950000000000 108.546000000000 107.170000000000 Box info found: 51.8480000000000 1.11000000000000 43.3080000000000 Box info found: 67.2290000000000 59.6510000000000 -2.27300000000000 Box info found: 52.6540000000000 -4.52200000000000 60.6650000000000 Box info found: 25.7340000000000 69.1730000000000 8.56900000000000 Box info found: 26.9320000000000 -3.63300000000000 109.500000000000 Box info found: 35.2230000000000 55.8040000000000 59.3070000000000 Box info found: 100.155000000000 52.2750000000000 92.3710000000000 Box info found: 40.9020000000000 78.8470000000000 18.5370000000000 Box info found: 5.71900000000000 41.2290000000000 79.8230000000000 Box info found: 27.4600000000000 44.8790000000000 23.2480000000000 Box info found: -23.4960000000000 8.70700000000000 39.6280000000000 Box info found: 95.3390000000000 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