REMARK  Name = LIG000210
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.957  -3.140  -0.430  0.00  0.00    +0.052 A 
ATOM      2  C   LIG    1        1.194  -3.333  -1.627  0.00  0.00    +0.137 A 
ATOM      3  C   LIG    1        0.605  -4.580  -1.671  0.00  0.00    +0.091 A 
ATOM      4  S   LIG    1        0.909  -5.489  -0.255  0.00  0.00    -0.101 S 
ATOM      5  C   LIG    1        1.873  -4.239   0.403  0.00  0.00    +0.059 A 
ENDROOT
BRANCH   1   9
ATOM      6  N   LIG    1        3.978  -0.404   0.753  0.00  0.00    -0.239 N 
ATOM      7  N   LIG    1        3.454   0.117  -0.371  0.00  0.00    -0.064 NA
ATOM      8  N   LIG    1        2.687  -0.816  -0.919  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        2.719  -1.927  -0.119  0.00  0.00    +0.117 A 
ATOM     10  C   LIG    1        3.552  -1.685   0.952  0.00  0.00    +0.139 A 
BRANCH   6  17
ATOM     11  O   LIG    1        6.673   3.798   3.005  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        6.137   2.836   2.463  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1        4.817   2.537   2.689  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1        4.342   3.156   3.335  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1        4.193   1.331   2.460  0.00  0.00    +0.244 C 
ATOM     16  O   LIG    1        3.156   1.052   3.060  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1        4.922   0.353   1.554  0.00  0.00    +0.195 C 
ATOM     18  C   LIG    1        5.976   1.070   0.704  0.00  0.00    +0.045 C 
ATOM     19  C   LIG    1        6.908   1.861   1.607  0.00  0.00    +0.099 C 
ENDBRANCH   6  17
ENDBRANCH   1   9
BRANCH   2  20
ATOM     20  O   LIG    1        1.129  -2.426  -2.637  0.00  0.00    -0.486 OA
BRANCH  20  21
ATOM     21  C   LIG    1       -0.174  -2.223  -3.193  0.00  0.00    +0.264 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -1.146  -1.558  -2.245  0.00  0.00    -0.010 A 
ATOM     23  C   LIG    1       -2.441  -2.067  -2.080  0.00  0.00    +0.007 A 
ATOM     24  C   LIG    1       -3.342  -1.443  -1.214  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1       -2.972  -0.293  -0.503  0.00  0.00    -0.033 A 
ATOM     26  C   LIG    1       -1.677   0.217  -0.671  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -0.778  -0.405  -1.539  0.00  0.00    +0.007 A 
BRANCH  25  28
ATOM     28  C   LIG    1       -3.942   0.373   0.451  0.00  0.00    +0.119 C 
BRANCH  28  29
ATOM     29  N   LIG    1       -5.220   0.751  -0.178  0.00  0.00    -0.294 NA
ATOM     30  C   LIG    1       -5.068   1.813  -1.199  0.00  0.00    +0.113 C 
ATOM     31  C   LIG    1       -4.787   3.208  -0.620  0.00  0.00    +0.175 C 
ATOM     32  O   LIG    1       -5.793   3.594   0.325  0.00  0.00    -0.377 OA
ATOM     33  C   LIG    1       -5.897   2.630   1.380  0.00  0.00    +0.175 C 
ATOM     34  C   LIG    1       -6.192   1.223   0.833  0.00  0.00    +0.113 C 
ENDBRANCH  28  29
ENDBRANCH  25  28
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 7