[ moleculetype ]
; Name            nrexcl
benzyl-alcohol                 3

[ atoms ]
;   nr       type  resnr residue  atom   cgnr     charge       mass  typeB    chargeB      massB
         1  opls_145         1       LIG         C         1    -0.115    12.011
         2  opls_146         1       LIG         H         2     0.115     1.008
         3  opls_145         1       LIG         C         3    -0.115    12.011
         4  opls_146         1       LIG         H         4     0.115     1.008
         5  opls_145         1       LIG         C         5    -0.115    12.011
         6  opls_146         1       LIG         H         6     0.115     1.008
         7  opls_145         1       LIG         C         7    -0.115    12.011
         8  opls_146         1       LIG         H         8     0.115     1.008
         9  opls_145         1       LIG         C         9    -0.115    12.011
        10  opls_146         1       LIG         H        10     0.115     1.008
        11  opls_221         1       LIG         C        11    -0.055    12.011
        12  opls_218         1       LIG         C        12       0.2    12.011
        13  opls_140         1       LIG         H        13     0.060     1.008
        14  opls_140         1       LIG         H        14     0.060     1.008
        15  opls_154         1       LIG         O        15    -0.683   15.9994
        16  opls_155         1       LIG         H        16     0.418     1.008

[ bonds ]
;  ai    aj funct            c0            c1            c2            c3
    1     2     1 
    1     3     1 
    1    11     1 
    3     4     1 
    3     5     1 
    5     6     1 
    5     7     1 
    7     8     1 
    7     9     1 
    9    10     1 
    9    11     1 
   11    12     1 
   12    13     1 
   12    14     1 
   12    15     1 
   15    16     1 

[ pairs ]
;  ai    aj funct            c0            c1            c2            c3
    1     6     1 
    1     7     1 
    1    10     1 
    1    13     1 
    1    14     1 
    1    15     1 
    2     4     1 
    2     5     1 
    2     9     1 
    2    12     1 
    3     8     1 
    3     9     1 
    3    12     1 
    4     6     1 
    4     7     1 
    4    11     1 
    5    10     1 
    5    11     1 
    6     8     1 
    6     9     1 
    7    12     1 
    8    10     1 
    8    11     1 
    9    13     1 
    9    14     1 
    9    15     1 
   10    12     1 
   11    16     1 
   13    16     1 
   14    16     1 

[ angles ]
;  ai    aj    ak funct            c0            c1            c2            c3
    2     1     3     1 
    2     1    11     1 
    3     1    11     1 
    1     3     4     1 
    1     3     5     1 
    4     3     5     1 
    3     5     6     1 
    3     5     7     1 
    6     5     7     1 
    5     7     8     1 
    5     7     9     1 
    8     7     9     1 
    7     9    10     1 
    7     9    11     1 
   10     9    11     1 
    1    11     9     1 
    1    11    12     1 
    9    11    12     1 
   11    12    13     1 
   11    12    14     1 
   11    12    15     1 
   13    12    14     1 
   13    12    15     1 
   14    12    15     1 
   12    15    16     1 

[ dihedrals ]
;  ai    aj    ak    al funct            c0            c1            c2            c3            c4            c5
    2     1     3     4     3 
    2     1     3     5     3 
   11     1     3     4     3 
   11     1     3     5     3 
    2     1    11     9     3 
    2     1    11    12     3 
    3     1    11     9     3 
    3     1    11    12     3 
    1     3     5     6     3 
    1     3     5     7     3 
    4     3     5     6     3 
    4     3     5     7     3 
    3     5     7     8     3 
    3     5     7     9     3 
    6     5     7     8     3 
    6     5     7     9     3 
    5     7     9    10     3 
    5     7     9    11     3 
    8     7     9    10     3 
    8     7     9    11     3 
    7     9    11     1     3 
    7     9    11    12     3 
   10     9    11     1     3 
   10     9    11    12     3 
    1    11    12    13     3 
    1    11    12    14     3 
    1    11    12    15     3 
    9    11    12    13     3 
    9    11    12    14     3 
    9    11    12    15     3 
   11    12    15    16     3 
   13    12    15    16     3 
   14    12    15    16     3 

; added, improper
   1     11     3     2     1   180     4.6     2
   3      1     5     4     1   180     4.6     2
   5      3     7     6     1   180     4.6     2
   7      5     9     8     1   180     4.6     2
   9      7    11    10     1   180     4.6     2
  11      9     1    12     1   180     4.6     2
; ring_180
    1     3     5     7     1   180     4.6     2
    3     5     7     9     1   180     4.6     2
    5     7     9    11     1   180     4.6     2
    7     9    11     1     1   180     4.6     2
    9    11     1     3     1   180     4.6     2
   11     1     3     5     1   180     4.6     2