REMARK  Name = BDB001367
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.091  -0.521  -0.001  0.00  0.00    +0.192 C 
ATOM      2  N   LIG    1       -0.336   0.571   0.936  0.00  0.00    -0.257 N 
ATOM      3  C   LIG    1        0.063   0.263   2.223  0.00  0.00    +0.250 C 
ATOM      4  O   LIG    1        0.029   0.965   3.215  0.00  0.00    -0.270 OA
ATOM      5  C   LIG    1        0.594  -1.104   2.197  0.00  0.00    +0.045 A 
ATOM      6  C   LIG    1        1.113  -1.852   3.237  0.00  0.00    +0.013 A 
ATOM      7  C   LIG    1        1.575  -3.134   2.937  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        1.510  -3.630   1.622  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1        0.982  -2.853   0.585  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1        0.523  -1.580   0.889  0.00  0.00    +0.019 A 
ENDROOT
BRANCH   1  11
ATOM     11  C   LIG    1       -1.379  -1.042  -0.657  0.00  0.00    +0.007 A 
ATOM     12  C   LIG    1       -2.497  -1.397   0.124  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1       -3.665  -1.887  -0.466  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1       -3.737  -2.042  -1.847  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1       -2.642  -1.710  -2.639  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -1.474  -1.217  -2.051  0.00  0.00    +0.008 A 
ENDBRANCH   1  11
BRANCH   1  17
ATOM     17  O   LIG    1        0.813  -0.069  -1.020  0.00  0.00    -0.344 OA
BRANCH  17  18
ATOM     18  C   LIG    1        2.118   0.330  -0.606  0.00  0.00    +0.204 C 
BRANCH  18  19
ATOM     19  C   LIG    1        2.865   0.882  -1.819  0.00  0.00    +0.260 C 
BRANCH  19  20
ATOM     20  O   LIG    1        4.160   1.376  -1.453  0.00  0.00    -0.459 OA
BRANCH  20  21
ATOM     21  C   LIG    1        5.130   0.435  -1.349  0.00  0.00    +0.331 C 
ATOM     22  O   LIG    1        4.989  -0.766  -1.520  0.00  0.00    -0.246 OA
BRANCH  21  24
ATOM     23  C   LIG    1        6.655   2.334  -0.772  0.00  0.00    +0.015 C 
ATOM     24  C   LIG    1        6.433   1.030  -0.983  0.00  0.00    +0.084 C 
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   1  17
BRANCH   2  25
ATOM     25  C   LIG    1       -0.844   1.869   0.537  0.00  0.00    +0.146 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -2.344   1.991   0.645  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -2.965   2.077   1.900  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -4.353   2.181   2.001  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.136   2.201   0.850  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -4.533   2.118  -0.403  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -3.144   2.015  -0.506  0.00  0.00    +0.005 A 
ENDBRANCH  25  26
ENDBRANCH   2  25
TORSDOF 9