REMARK  Name = BDB007713
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.593  -0.480   0.412  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   4
ATOM      2  O   LIG    1        1.950   0.779  -1.756  0.00  0.00    -0.270 OA
ATOM      3  C   LIG    1        2.604   0.369  -0.801  0.00  0.00    +0.246 C 
ATOM      4  N   LIG    1        2.032  -0.310   0.249  0.00  0.00    -0.309 N 
ATOM      5  H   LIG    1        2.639  -0.568   1.028  0.00  0.00    +0.149 HD
BRANCH   3   6
ATOM      6  C   LIG    1        4.072   0.581  -0.749  0.00  0.00    +0.064 A 
ATOM      7  C   LIG    1        4.855   0.144   0.337  0.00  0.00    +0.101 A 
ATOM      8  C   LIG    1        6.229   0.379   0.320  0.00  0.00    +0.067 A 
ATOM      9  N   LIG    1        6.685  -0.158   1.497  0.00  0.00    -0.344 N 
ATOM     10  H   LIG    1        7.644  -0.164   1.814  0.00  0.00    +0.167 HD
ATOM     11  C   LIG    1        5.617  -0.683   2.167  0.00  0.00    +0.197 A 
ATOM     12  C   LIG    1        6.885   1.033  -0.725  0.00  0.00    +0.028 A 
ATOM     13  C   LIG    1        6.095   1.463  -1.796  0.00  0.00    +0.003 A 
ATOM     14  N   LIG    1        4.498  -0.520   1.499  0.00  0.00    -0.235 NA
ATOM     15  C   LIG    1        4.715   1.244  -1.812  0.00  0.00    +0.015 A 
ENDBRANCH   3   6
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  C   LIG    1       -0.033  -1.399  -0.655  0.00  0.00    +0.145 C 
BRANCH  16  17
ATOM     17  O   LIG    1       -0.270  -0.708  -1.888  0.00  0.00    -0.389 OA
ATOM     18  H   LIG    1        0.504  -0.115  -2.026  0.00  0.00    +0.210 HD
ENDBRANCH  16  17
BRANCH  16  19
ATOM     19  C   LIG    1       -1.352  -2.050  -0.169  0.00  0.00    +0.117 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -2.341  -1.149   0.467  0.00  0.00    -0.295 NA
ATOM     21  C   LIG    1       -2.845  -0.145  -0.497  0.00  0.00    +0.120 C 
ATOM     22  C   LIG    1       -4.030   0.657   0.011  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1       -4.806   0.205   1.091  0.00  0.00    -0.042 A 
ATOM     24  C   LIG    1       -5.908   0.957   1.522  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1       -6.253   2.139   0.866  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -5.499   2.580  -0.218  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -4.413  -1.052   1.819  0.00  0.00    +0.051 C 
ATOM     28  C   LIG    1       -4.394   1.843  -0.645  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1       -3.473  -1.935   0.989  0.00  0.00    +0.089 C 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   1  16
TORSDOF 6