REMARK  Name = LIG001153
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.150   0.178   0.135  0.00  0.00    -0.239 N 
ATOM      2  N   LIG    1        0.073   1.447   0.525  0.00  0.00    -0.064 NA
ATOM      3  N   LIG    1        1.379   1.664   0.440  0.00  0.00    -0.129 NA
ATOM      4  C   LIG    1        1.974   0.516  -0.009  0.00  0.00    +0.113 A 
ATOM      5  C   LIG    1        1.012  -0.444  -0.221  0.00  0.00    +0.139 A 
ENDROOT
BRANCH   1  12
ATOM      6  O   LIG    1       -5.484  -0.498   1.168  0.00  0.00    -0.275 OA
ATOM      7  C   LIG    1       -4.308  -0.349   0.853  0.00  0.00    +0.219 C 
ATOM      8  N   LIG    1       -3.296  -0.611   1.742  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1       -3.594  -0.944   2.651  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1       -1.962  -0.793   1.453  0.00  0.00    +0.244 C 
ATOM     11  O   LIG    1       -1.236  -1.379   2.254  0.00  0.00    -0.273 OA
ATOM     12  C   LIG    1       -1.500  -0.354   0.074  0.00  0.00    +0.195 C 
ATOM     13  C   LIG    1       -2.493   0.628  -0.556  0.00  0.00    +0.045 C 
ATOM     14  C   LIG    1       -3.888   0.025  -0.548  0.00  0.00    +0.099 C 
ENDBRANCH   1  12
BRANCH   4  15
ATOM     15  C   LIG    1        3.421   0.446  -0.201  0.00  0.00    +0.011 A 
ATOM     16  C   LIG    1        4.294   1.491   0.022  0.00  0.00    +0.055 A 
ATOM     17  S   LIG    1        5.918   1.062  -0.306  0.00  0.00    -0.104 S 
ATOM     18  C   LIG    1        5.465  -0.528  -0.744  0.00  0.00    +0.046 A 
ATOM     19  C   LIG    1        4.104  -0.727  -0.645  0.00  0.00    +0.018 A 
ENDBRANCH   4  15
TORSDOF 2