REMARK  Name = BDB032210
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.790   0.353  -0.436  0.00  0.00    +0.215 A 
ATOM      2  N   LIG    1       -1.182  -0.516  -1.271  0.00  0.00    -0.221 NA
ATOM      3  C   LIG    1        0.166  -0.440  -1.350  0.00  0.00    +0.119 A 
ATOM      4  C   LIG    1        0.944   0.463  -0.632  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1        0.275   1.346   0.222  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1       -1.112   1.291   0.324  0.00  0.00    +0.067 A 
ENDROOT
BRANCH   1   7
ATOM      7  O   LIG    1       -3.164   0.335  -0.301  0.00  0.00    -0.476 OA
BRANCH   7   8
ATOM      8  C   LIG    1       -3.803  -0.626  -1.145  0.00  0.00    +0.234 C 
BRANCH   8  14
ATOM      9  C   LIG    1       -9.267   0.248   0.311  0.00  0.00    +0.132 C 
ATOM     10  N   LIG    1       -7.862   0.139  -0.030  0.00  0.00    -0.305 N 
ATOM     11  C   LIG    1       -7.387   0.831  -1.141  0.00  0.00    +0.216 C 
ATOM     12  O   LIG    1       -8.105   1.430  -1.936  0.00  0.00    -0.276 OA
ATOM     13  C   LIG    1       -5.877   0.827  -1.279  0.00  0.00    +0.103 C 
ATOM     14  C   LIG    1       -5.321  -0.557  -0.934  0.00  0.00    +0.037 C 
ATOM     15  C   LIG    1       -5.719  -0.973   0.495  0.00  0.00    +0.026 C 
ATOM     16  C   LIG    1       -6.928  -0.207   1.027  0.00  0.00    +0.108 C 
ENDBRANCH   8  14
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   4  17
ATOM     17  C   LIG    1        2.441   0.494  -0.782  0.00  0.00    +0.138 C 
BRANCH  17  18
ATOM     18  N   LIG    1        3.067   0.214   0.503  0.00  0.00    -0.340 N 
ATOM     19  H   LIG    1        2.587  -0.522   1.018  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1        4.457   0.087   0.589  0.00  0.00    +0.028 A 
ATOM     21  C   LIG    1        5.349   0.649  -0.332  0.00  0.00    +0.031 A 
ATOM     22  C   LIG    1        6.747   0.558  -0.170  0.00  0.00    -0.011 A 
ATOM     23  C   LIG    1        7.286  -0.088   0.961  0.00  0.00    +0.022 A 
ATOM     24  C   LIG    1        8.698  -0.151   1.069  0.00  0.00    +0.124 A 
ATOM     25  N   LIG    1        9.529   0.375   0.150  0.00  0.00    -0.240 NA
ATOM     26  C   LIG    1        8.979   0.989  -0.914  0.00  0.00    +0.113 A 
ATOM     27  C   LIG    1        6.384  -0.616   1.909  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1        7.617   1.106  -1.117  0.00  0.00    +0.028 A 
ATOM     29  C   LIG    1        5.000  -0.515   1.728  0.00  0.00    +0.023 A 
BRANCH  24  30
ATOM     30  N   LIG    1        9.318  -0.773   2.164  0.00  0.00    -0.343 N 
ATOM     31  H   LIG    1        9.033  -0.304   3.018  0.00  0.00    +0.144 HD
ATOM     32  H   LIG    1        9.021  -1.742   2.209  0.00  0.00    +0.144 HD
ENDBRANCH  24  30
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 7