REMARK  Name = BDB014972
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.567  -3.033  -1.465  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.329  -2.227  -2.111  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1        1.495  -1.965  -1.383  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1        2.513  -1.154  -1.907  0.00  0.00    -0.030 A 
ATOM      5  C   LIG    1        2.343  -0.602  -3.182  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1        1.185  -0.860  -3.913  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        0.180  -1.671  -3.381  0.00  0.00    +0.045 A 
BRANCH   4   8
ATOM      8  C   LIG    1        3.764  -0.873  -1.109  0.00  0.00    +0.116 C 
BRANCH   8   9
ATOM      9  N   LIG    1        3.832   0.538  -0.737  0.00  0.00    -0.309 NA
ATOM     10  H   LIG    1        2.990   0.787  -0.218  0.00  0.00    +0.123 HD
BRANCH   9  11
ATOM     11  C   LIG    1        5.026   0.877   0.041  0.00  0.00    +0.054 C 
ATOM     12  C   LIG    1        5.213   2.406  -0.022  0.00  0.00    +0.019 C 
ATOM     13  C   LIG    1        6.107   2.966   1.090  0.00  0.00    +0.002 C 
ATOM     14  C   LIG    1        7.028   1.911   1.682  0.00  0.00    +0.000 C 
ATOM     15  C   LIG    1        6.241   0.737   2.266  0.00  0.00    +0.002 C 
ATOM     16  C   LIG    1        4.949   0.420   1.503  0.00  0.00    +0.019 C 
ENDBRANCH   9  11
ENDBRANCH   8   9
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1       -1.825  -3.296  -2.083  0.00  0.00    +0.261 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -2.853  -2.176  -1.844  0.00  0.00    +0.166 C 
BRANCH  18  19
ATOM     19  O   LIG    1       -4.037  -2.506  -2.586  0.00  0.00    -0.387 OA
ATOM     20  H   LIG    1       -3.869  -2.262  -3.512  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1       -3.185  -2.041  -0.336  0.00  0.00    +0.119 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -3.805  -0.751   0.056  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1       -3.856  -0.672   1.532  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1       -4.605   0.530   2.065  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1       -5.533   1.214   1.264  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1       -6.241   2.303   1.790  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -6.049   2.694   3.114  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -5.145   2.006   3.919  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.711   0.817  -0.177  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1       -4.428   0.928   3.399  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1       -5.162  -0.584  -0.487  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 9