REMARK  Name = LIG001908
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -5.354   0.408  -0.143  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -4.869   1.370   0.729  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -5.492   2.254   1.284  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -3.422   1.157   0.831  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -3.075   0.111  -0.020  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1       -1.754  -0.293  -0.126  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1       -0.777   0.369   0.638  0.00  0.00    +0.034 A 
ATOM      8  C   LIG    1       -1.154   1.431   1.485  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1       -2.490   1.835   1.589  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -4.292  -0.414  -0.709  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1       -9.737   0.015  -3.447  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -8.888   0.170  -2.575  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -8.434  -0.892  -1.835  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -8.800  -1.794  -2.111  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -7.297  -0.932  -1.060  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -6.822  -2.015  -0.726  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -6.725   0.434  -0.646  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -6.854   1.409  -1.819  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -8.311   1.523  -2.236  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   7  20
ATOM     20  N   LIG    1        0.554  -0.078   0.492  0.00  0.00    -0.281 N 
ATOM     21  H   LIG    1        0.689  -0.855  -0.141  0.00  0.00    +0.155 HD
ATOM     22  C   LIG    1        1.668   0.357   1.189  0.00  0.00    +0.248 C 
ATOM     23  O   LIG    1        1.694   1.169   2.105  0.00  0.00    -0.270 OA
BRANCH  22  24
ATOM     24  C   LIG    1        2.950  -0.281   0.778  0.00  0.00    +0.037 A 
ATOM     25  C   LIG    1        3.901  -0.565   1.764  0.00  0.00    +0.014 A 
ATOM     26  C   LIG    1        5.115  -1.165   1.417  0.00  0.00    +0.016 A 
ATOM     27  C   LIG    1        5.397  -1.467   0.080  0.00  0.00    +0.013 A 
ATOM     28  C   LIG    1        4.447  -1.173  -0.905  0.00  0.00    +0.016 A 
ATOM     29  C   LIG    1        3.230  -0.576  -0.562  0.00  0.00    +0.014 A 
BRANCH  27  30
ATOM     30  S   LIG    1        6.931  -2.243  -0.398  0.00  0.00    -0.089 S 
BRANCH  30  31
ATOM     31  C   LIG    1        8.144  -1.146   0.316  0.00  0.00    +0.013 A 
ATOM     32  C   LIG    1        8.169   0.217   0.000  0.00  0.00    +0.015 A 
ATOM     33  C   LIG    1        9.132   1.055   0.568  0.00  0.00    +0.001 A 
ATOM     34  C   LIG    1       10.080   0.533   1.447  0.00  0.00    +0.000 A 
ATOM     35  C   LIG    1       10.068  -0.826   1.758  0.00  0.00    +0.001 A 
ATOM     36  C   LIG    1        9.104  -1.663   1.191  0.00  0.00    +0.015 A 
ENDBRANCH  30  31
ENDBRANCH  27  30
ENDBRANCH  22  24
ENDBRANCH   7  20
TORSDOF 5