REMARK  Name = BDB015151
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.685   0.764  -0.240  0.00  0.00    -0.014 A 
ATOM      2  C   LIG    1        2.050  -0.487  -0.147  0.00  0.00    +0.054 A 
ATOM      3  C   LIG    1        0.813  -0.640   0.491  0.00  0.00    +0.121 A 
ATOM      4  C   LIG    1        0.196   0.475   1.054  0.00  0.00    +0.045 A 
ATOM      5  C   LIG    1        0.807   1.727   0.974  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1        2.039   1.869   0.333  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        6.315   0.228  -1.213  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1        5.073   0.086  -0.578  0.00  0.00    +0.021 A 
ATOM      9  C   LIG    1        3.985   0.908  -0.916  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1        4.176   1.871  -1.922  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1        5.405   2.007  -2.572  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        6.475   1.185  -2.222  0.00  0.00    +0.013 A 
BRANCH   7  16
ATOM     13  C   LIG    1        9.841  -0.910  -0.459  0.00  0.00    +0.128 C 
ATOM     14  N   LIG    1        8.705  -0.166  -0.945  0.00  0.00    -0.314 N 
ATOM     15  H   LIG    1        8.817   0.830  -1.073  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        7.428  -0.672  -0.804  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1        7.188  -1.781  -0.341  0.00  0.00    -0.270 OA
ENDBRANCH   7  16
ENDBRANCH   1   9
BRANCH   3  18
ATOM     18  O   LIG    1        0.332  -1.920   0.488  0.00  0.00    -0.489 OA
BRANCH  18  19
ATOM     19  C   LIG    1       -0.967  -2.171   1.044  0.00  0.00    +0.261 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.072  -1.899   0.010  0.00  0.00    +0.166 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -2.062  -2.951  -0.972  0.00  0.00    -0.387 OA
ATOM     22  H   LIG    1       -2.558  -2.627  -1.743  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -3.471  -1.860   0.662  0.00  0.00    +0.119 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -3.668  -0.745   1.606  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -3.862   0.553   0.927  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -5.229   0.757   0.309  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -6.344   0.026   0.762  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -7.604   0.260   0.197  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -7.764   1.226  -0.795  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -6.667   1.964  -1.232  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -6.173  -1.050   1.805  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -5.406   1.734  -0.681  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -4.810  -0.983   2.509  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 8