 c4w 
 &cntrl
  ioutopt=1, iqopt=1, nmol=12, ihfree=1, irstrnt=1, qwt= 0.0005 
 &end 
  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0

  1.0
 c4w 
   1   13
   8    0
   1    0
   1    2
   8    0
   1    0
   1    5
   8    0
   1    0
   1    8
   8    0
   1    0
   1   11
  29    0


   8
   1    1    2    1    3    1    4    1    5    1    6    1    7    1    8    1
   5
   8    1    9    1   10    1   11    1   12    1
   8
   1    2    2    2    3    2    4    2    5    2    6    2    7    2    8    2
   5
   8    2    9    2   10    2   11    2   12    2
   8
   1    4    2    4    3    4    4    4    5    4    6    4    7    4    8    4
   5
   8    4    9    4   10    4   11    4   12    4
   8
   1    5    2    5    3    5    4    5    5    5    6    5    7    5    8    5
   5
   8    5    9    5   10    5   11    5   12    5
   8
   1    7    2    7    3    7    4    7    5    7    6    7    7    7    8    7
   5
   8    7    9    7   10    7   11    7   12    7
   8
   1    8    2    8    3    8    4    8    5    8    6    8    7    8    8    8
   5
   8    8    9    8   10    8   11    8   12    8
   8
   1   10    2   10    3   10    4   10    5   10    6   10    7   10    8   10
   5
   8   10    9   10   10   10   11   10   12   10
   8
   1   11    2   11    3   11    4   11    5   11    6   11    7   11    8   11
   5
   8   11    9   11   10   11   11   11   12   11
   8
   1   13    2   13    3   13    4   13    5   13    6   13    7   13    8   13
   5
   8   13    9   13   10   13   11   13   12   13






