REMARK  Name = BDB007663
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.113  -0.494  -4.028  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        0.944   0.305  -3.113  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1       -0.282   0.516  -2.522  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1       -0.438   1.351  -1.973  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        2.085   1.128  -2.624  0.00  0.00    +0.041 A 
ATOM      6  C   LIG    1        2.064   1.794  -1.399  0.00  0.00    +0.056 A 
ATOM      7  C   LIG    1        3.171   2.552  -1.022  0.00  0.00    +0.120 A 
ATOM      8  N   LIG    1        4.257   2.659  -1.814  0.00  0.00    -0.240 NA
ATOM      9  C   LIG    1        4.271   1.984  -2.979  0.00  0.00    +0.113 A 
ATOM     10  C   LIG    1        3.220   1.213  -3.426  0.00  0.00    +0.033 A 
BRANCH   7  11
ATOM     11  N   LIG    1        3.131   3.178   0.233  0.00  0.00    -0.325 N 
ATOM     12  H   LIG    1        2.291   3.751   0.277  0.00  0.00    +0.148 HD
BRANCH  11  13
ATOM     13  C   LIG    1        4.314   3.948   0.606  0.00  0.00    +0.138 C 
BRANCH  13  14
ATOM     14  C   LIG    1        5.441   3.067   1.091  0.00  0.00    -0.028 A 
ATOM     15  C   LIG    1        5.320   2.307   2.259  0.00  0.00    +0.025 A 
ATOM     16  C   LIG    1        6.394   1.522   2.655  0.00  0.00    +0.111 A 
ATOM     17  N   LIG    1        7.568   1.449   1.988  0.00  0.00    -0.263 NA
ATOM     18  C   LIG    1        7.659   2.175   0.854  0.00  0.00    +0.111 A 
ATOM     19  C   LIG    1        6.639   2.989   0.372  0.00  0.00    +0.025 A 
ENDBRANCH  13  14
ENDBRANCH  11  13
ENDBRANCH   7  11
ENDBRANCH   2   5
BRANCH   3  20
ATOM     20  C   LIG    1       -1.494  -0.053  -3.086  0.00  0.00    +0.137 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -2.607  -0.195  -2.033  0.00  0.00    +0.145 C 
BRANCH  21  22
ATOM     22  O   LIG    1       -2.749   1.039  -1.312  0.00  0.00    -0.389 OA
ATOM     23  H   LIG    1       -3.269   0.803  -0.510  0.00  0.00    +0.210 HD
ENDBRANCH  21  22
BRANCH  21  24
ATOM     24  C   LIG    1       -2.308  -1.349  -1.045  0.00  0.00    +0.117 C 
BRANCH  24  25
ATOM     25  N   LIG    1       -3.305  -1.473   0.050  0.00  0.00    -0.295 NA
ATOM     26  C   LIG    1       -2.807  -2.481   1.017  0.00  0.00    +0.120 C 
ATOM     27  C   LIG    1       -3.812  -2.891   2.073  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1       -5.183  -2.653   1.900  0.00  0.00    -0.042 A 
ATOM     29  C   LIG    1       -6.095  -3.083   2.873  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1       -5.651  -3.782   3.993  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -4.295  -4.046   4.154  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -5.659  -1.896   0.692  0.00  0.00    +0.051 C 
ATOM     33  C   LIG    1       -3.380  -3.602   3.200  0.00  0.00    +0.005 A 
ATOM     34  C   LIG    1       -4.625  -1.903  -0.445  0.00  0.00    +0.089 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   3  20
TORSDOF 9