REMARK  Name = BDB007830
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.339   0.273  -0.153  0.00  0.00    +0.129 A 
ATOM      2  N   LIG    1        1.198  -0.437  -0.077  0.00  0.00    -0.196 NA
ATOM      3  C   LIG    1        0.030   0.237  -0.164  0.00  0.00    +0.240 A 
ATOM      4  O   LIG    1       -1.067  -0.565  -0.023  0.00  0.00    -0.459 OA
ATOM      5  C   LIG    1       -2.192   0.100   0.551  0.00  0.00    +0.185 C 
ATOM      6  C   LIG    1       -2.508   1.460  -0.125  0.00  0.00    +0.268 C 
ATOM      7  N   LIG    1       -1.374   2.211  -0.474  0.00  0.00    -0.232 N 
ATOM      8  O   LIG    1       -3.672   1.837  -0.283  0.00  0.00    -0.271 OA
ATOM      9  C   LIG    1       -1.960   0.338   2.055  0.00  0.00    +0.066 C 
ATOM     10  C   LIG    1       -0.082   1.611  -0.371  0.00  0.00    +0.103 A 
ATOM     11  C   LIG    1        1.119   2.323  -0.400  0.00  0.00    +0.032 A 
ATOM     12  C   LIG    1        2.340   1.650  -0.298  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   7  13
ATOM     13  C   LIG    1       -1.521   3.518  -1.039  0.00  0.00    +0.042 A 
ATOM     14  C   LIG    1       -2.436   4.428  -0.489  0.00  0.00    +0.024 A 
ATOM     15  C   LIG    1       -2.599   5.704  -1.036  0.00  0.00    +0.002 A 
ATOM     16  C   LIG    1       -1.859   6.086  -2.152  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -0.965   5.188  -2.728  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1       -0.802   3.912  -2.180  0.00  0.00    +0.024 A 
ENDBRANCH   7  13
BRANCH   1  20
ATOM     19  C   LIG    1        4.807  -0.114  -0.149  0.00  0.00    +0.235 C 
ATOM     20  N   LIG    1        3.490  -0.500  -0.051  0.00  0.00    -0.269 N 
ATOM     21  H   LIG    1        3.321  -1.497   0.045  0.00  0.00    +0.156 HD
ATOM     22  O   LIG    1        5.217   1.027  -0.344  0.00  0.00    -0.274 OA
BRANCH  19  23
ATOM     23  C   LIG    1        5.785  -1.292   0.071  0.00  0.00    +0.137 C 
ATOM     24  C   LIG    1        6.013  -1.444   1.574  0.00  0.00    +0.034 C 
BRANCH  23  26
ATOM     25  C   LIG    1        6.133  -3.646  -0.494  0.00  0.00    +0.101 C 
ATOM     26  N   LIG    1        5.211  -2.516  -0.547  0.00  0.00    -0.309 NA
ATOM     27  H   LIG    1        5.029  -2.310  -1.533  0.00  0.00    +0.122 HD
ENDBRANCH  23  26
ENDBRANCH  19  23
ENDBRANCH   1  20
BRANCH   5  28
ATOM     28  C   LIG    1       -3.409  -0.842   0.343  0.00  0.00    +0.059 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -3.231  -2.256   0.923  0.00  0.00    +0.022 C 
BRANCH  29  30
ATOM     30  C   LIG    1       -4.381  -3.210   0.557  0.00  0.00    +0.048 C 
ATOM     31  C   LIG    1       -4.081  -4.623   1.058  0.00  0.00    +0.023 C 
BRANCH  30  32
ATOM     32  N   LIG    1       -5.647  -2.763   1.137  0.00  0.00    -0.328 NA
ATOM     33  H   LIG    1       -5.934  -1.883   0.709  0.00  0.00    +0.118 HD
ATOM     34  H   LIG    1       -6.383  -3.432   0.912  0.00  0.00    +0.118 HD
ENDBRANCH  30  32
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH   5  28
TORSDOF 8