REMARK  Name = BDB015120
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.025   1.966   0.096  0.00  0.00    +0.261 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.892   1.025   0.946  0.00  0.00    +0.166 C 
BRANCH   2   3
ATOM      3  O   LIG    1        0.713   1.354   2.334  0.00  0.00    -0.387 OA
ATOM      4  H   LIG    1       -0.253   1.395   2.473  0.00  0.00    +0.210 HD
ENDBRANCH   2   3
BRANCH   2   5
ATOM      5  C   LIG    1        2.389   1.152   0.602  0.00  0.00    +0.119 C 
BRANCH   5   6
ATOM      6  N   LIG    1        2.729   0.785  -0.786  0.00  0.00    -0.295 NA
ATOM      7  C   LIG    1        4.106   1.204  -1.127  0.00  0.00    +0.120 C 
ATOM      8  C   LIG    1        5.204   0.323  -0.569  0.00  0.00    -0.030 A 
ATOM      9  C   LIG    1        4.948  -1.013  -0.210  0.00  0.00    -0.042 A 
ATOM     10  C   LIG    1        5.991  -1.817   0.268  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1        7.285  -1.307   0.369  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1        7.545   0.009  -0.003  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        3.545  -1.562  -0.277  0.00  0.00    +0.051 C 
ATOM     14  C   LIG    1        6.512   0.820  -0.473  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1        2.591  -0.655  -1.069  0.00  0.00    +0.089 C 
ENDBRANCH   5   6
ENDBRANCH   2   5
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  O   LIG    1       -1.357   1.821   0.458  0.00  0.00    -0.489 OA
BRANCH  16  17
ATOM     17  C   LIG    1       -2.093   0.831  -0.132  0.00  0.00    +0.121 A 
ATOM     18  C   LIG    1       -3.404   0.723   0.349  0.00  0.00    +0.054 A 
ATOM     19  C   LIG    1       -4.297  -0.247  -0.141  0.00  0.00    -0.012 A 
ATOM     20  C   LIG    1       -3.830  -1.115  -1.139  0.00  0.00    +0.009 A 
ATOM     21  C   LIG    1       -2.527  -1.013  -1.628  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1       -1.660  -0.041  -1.127  0.00  0.00    +0.045 A 
BRANCH  19  23
ATOM     23  C   LIG    1       -5.676  -0.341   0.373  0.00  0.00    +0.017 A 
ATOM     24  C   LIG    1       -6.231  -1.560   0.792  0.00  0.00    +0.131 A 
ATOM     25  F   LIG    1       -5.506  -2.689   0.743  0.00  0.00    -0.205 F 
ATOM     26  C   LIG    1       -7.536  -1.647   1.278  0.00  0.00    +0.039 A 
ATOM     27  C   LIG    1       -8.324  -0.501   1.355  0.00  0.00    +0.003 A 
ATOM     28  C   LIG    1       -7.802   0.723   0.945  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -6.492   0.802   0.459  0.00  0.00    +0.011 A 
ENDBRANCH  19  23
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 7