REMARK  Name = BDB014465
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.381   1.254   1.120  0.00  0.00    +0.136 C 
ENDROOT
BRANCH   1   3
ATOM      2  C   LIG    1       -2.642   1.885   0.353  0.00  0.00    +0.234 C 
ATOM      3  N   LIG    1       -1.790   1.494   1.369  0.00  0.00    -0.311 N 
ATOM      4  H   LIG    1       -2.246   0.950   2.100  0.00  0.00    +0.149 HD
ATOM      5  O   LIG    1       -2.239   2.291  -0.736  0.00  0.00    -0.274 OA
BRANCH   2   6
ATOM      6  C   LIG    1       -4.147   1.739   0.703  0.00  0.00    +0.168 C 
BRANCH   6   7
ATOM      7  C   LIG    1       -4.788   0.608  -0.076  0.00  0.00    -0.022 A 
ATOM      8  C   LIG    1       -5.771   0.882  -1.040  0.00  0.00    +0.005 A 
ATOM      9  C   LIG    1       -6.364  -0.153  -1.765  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1       -5.984  -1.474  -1.537  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1       -5.008  -1.762  -0.585  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -4.414  -0.729   0.141  0.00  0.00    +0.005 A 
ENDBRANCH   6   7
BRANCH   6  13
ATOM     13  N   LIG    1       -4.330   1.538   2.165  0.00  0.00    -0.316 NA
ATOM     14  H   LIG    1       -5.330   1.438   2.337  0.00  0.00    +0.119 HD
ATOM     15  H   LIG    1       -4.046   2.400   2.632  0.00  0.00    +0.119 HD
ENDBRANCH   6  13
ENDBRANCH   2   6
ENDBRANCH   1   3
BRANCH   1  16
ATOM     16  C   LIG    1       -0.154  -0.116   0.463  0.00  0.00    +0.145 C 
BRANCH  16  17
ATOM     17  O   LIG    1       -0.444  -1.146   1.429  0.00  0.00    -0.389 OA
ATOM     18  H   LIG    1        0.394  -1.251   1.925  0.00  0.00    +0.210 HD
ENDBRANCH  16  17
BRANCH  16  19
ATOM     19  C   LIG    1        1.286  -0.318  -0.059  0.00  0.00    +0.117 C 
BRANCH  19  20
ATOM     20  N   LIG    1        2.248  -0.465   1.059  0.00  0.00    -0.295 NA
ATOM     21  C   LIG    1        3.196  -1.576   0.824  0.00  0.00    +0.120 C 
ATOM     22  C   LIG    1        4.268  -1.292  -0.204  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1        4.678   0.026  -0.469  0.00  0.00    -0.042 A 
ATOM     24  C   LIG    1        5.704   0.263  -1.394  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1        6.332  -0.803  -2.037  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        5.939  -2.111  -1.764  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        3.981   1.188   0.191  0.00  0.00    +0.051 C 
ATOM     28  C   LIG    1        4.915  -2.355  -0.849  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1        3.025   0.763   1.319  0.00  0.00    +0.089 C 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   1  16
TORSDOF 8