* LIGAND DATABASE FILE (OPLS2001)
*
NH2       3     2      1      0       3
    1     0 M   N    _N__     1     1.32628   118.64334   -34.64257
    2     1 S   H    _HN1     2     1.01000   120.00004  -179.97202
    3     1 S   H    _HN2     3     1.01000   119.99999    -0.02798
   2   1   1
    2     3
    3
    0
NBON
    1   3.2500   0.1700  -0.7600   1.9200   1.7000   0.168599800  -5.228863800
    2   0.5000   0.0300   0.3800   0.9960   0.8600   0.079817800  -1.129220000
    3   0.5000   0.0300   0.3800   0.9960   0.8600   0.079817800  -1.129220000
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
THET
    3     1     2    35.00000  120.00000
PHI
IPHI
END
