REMARK  Name = BDB015141
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.607  -0.399  -0.271  0.00  0.00    +0.004 A 
ATOM      2  C   LIG    1        1.502   0.380  -0.658  0.00  0.00    +0.055 A 
ATOM      3  C   LIG    1        1.047   0.412  -1.983  0.00  0.00    +0.121 A 
ATOM      4  C   LIG    1        1.716  -0.325  -2.957  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.822  -1.097  -2.603  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1        3.260  -1.132  -1.277  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  13
ATOM      7  C   LIG    1        7.275  -0.854   2.042  0.00  0.00    +0.150 C 
ATOM      8  N   LIG    1        6.156  -0.753   2.949  0.00  0.00    -0.335 N 
ATOM      9  C   LIG    1        4.849  -0.629   2.551  0.00  0.00    +0.141 A 
ATOM     10  C   LIG    1        4.067  -0.553   3.699  0.00  0.00    +0.019 A 
ATOM     11  C   LIG    1        2.684  -0.421   3.526  0.00  0.00    +0.013 A 
ATOM     12  C   LIG    1        2.200  -0.370   2.215  0.00  0.00    +0.029 A 
ATOM     13  C   LIG    1        3.083  -0.449   1.131  0.00  0.00    +0.073 A 
ATOM     14  C   LIG    1        4.948  -0.639   4.810  0.00  0.00    +0.029 A 
ATOM     15  N   LIG    1        4.425  -0.589   1.274  0.00  0.00    -0.229 NA
ATOM     16  C   LIG    1        6.231  -0.762   4.318  0.00  0.00    +0.088 A 
ENDBRANCH   1  13
BRANCH   3  17
ATOM     17  O   LIG    1       -0.044   1.209  -2.189  0.00  0.00    -0.489 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -0.698   1.101  -3.453  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.019   1.874  -3.416  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -2.753   1.614  -4.623  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -3.353   0.875  -4.389  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -2.934   1.586  -2.201  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.656   0.293  -2.312  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -4.971   0.360  -1.634  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -4.912   0.344  -0.122  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -3.824  -0.243   0.549  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -3.811  -0.285   1.950  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -4.880   0.233   2.680  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.966   0.799   2.018  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -2.646  -0.771  -0.230  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -5.985   0.851   0.624  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -2.913  -0.850  -1.742  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 7