REMARK  Name = BDB020152
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.962   1.133  -0.738  0.00  0.00    +0.040 A 
ATOM      2  C   LIG    1       -1.794   1.617   0.276  0.00  0.00    +0.058 A 
ATOM      3  C   LIG    1       -2.784   0.791   0.800  0.00  0.00    +0.122 A 
ATOM      4  C   LIG    1       -2.939  -0.506   0.293  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1       -2.145  -0.988  -0.765  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1       -1.161  -0.139  -1.286  0.00  0.00    +0.018 A 
ENDROOT
BRANCH   1   9
ATOM      7  N   LIG    1        1.196   2.344  -0.645  0.00  0.00    -0.304 N 
ATOM      8  H   LIG    1        1.771   2.935  -1.232  0.00  0.00    +0.150 HD
ATOM      9  C   LIG    1        0.055   2.014  -1.323  0.00  0.00    +0.245 C 
ATOM     10  O   LIG    1       -0.162   2.502  -2.428  0.00  0.00    -0.270 OA
BRANCH   7  11
ATOM     11  C   LIG    1        1.961   1.666   0.403  0.00  0.00    +0.107 C 
BRANCH  11  18
ATOM     12  C   LIG    1        6.673  -0.167   0.378  0.00  0.00    +0.047 C 
ATOM     13  C   LIG    1        5.262  -0.220  -0.122  0.00  0.00    -0.015 A 
ATOM     14  C   LIG    1        4.889  -1.158  -1.084  0.00  0.00    +0.126 A 
ATOM     15  F   LIG    1        5.790  -2.036  -1.546  0.00  0.00    -0.205 F 
ATOM     16  C   LIG    1        3.591  -1.205  -1.573  0.00  0.00    +0.039 A 
ATOM     17  C   LIG    1        2.642  -0.292  -1.111  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1        2.975   0.672  -0.149  0.00  0.00    -0.027 A 
ATOM     19  C   LIG    1        4.302   0.700   0.328  0.00  0.00    +0.011 A 
ENDBRANCH  11  18
BRANCH  11  20
ATOM     20  C   LIG    1        1.142   1.192   1.574  0.00  0.00    +0.014 C 
ATOM     21  C   LIG    1        1.757   0.410   2.717  0.00  0.00    +0.006 C 
ATOM     22  C   LIG    1        0.741  -0.246   1.828  0.00  0.00    +0.006 C 
ENDBRANCH  11  20
ENDBRANCH   7  11
ENDBRANCH   1   9
BRANCH   3  23
ATOM     23  O   LIG    1       -3.654   1.115   1.806  0.00  0.00    -0.492 OA
BRANCH  23  24
ATOM     24  C   LIG    1       -3.595   2.447   2.315  0.00  0.00    +0.232 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.673   2.594   3.345  0.00  0.00    +0.027 C 
ATOM     26  C   LIG    1       -4.603   3.693   4.374  0.00  0.00    +0.007 C 
ATOM     27  C   LIG    1       -4.409   2.260   4.792  0.00  0.00    +0.007 C 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   3  23
BRANCH   5  28
ATOM     28  C   LIG    1       -2.352  -2.410  -1.248  0.00  0.00    +0.160 C 
BRANCH  28  29
ATOM     29  N   LIG    1       -1.798  -2.676  -2.559  0.00  0.00    -0.313 N 
ATOM     30  C   LIG    1       -0.484  -3.088  -2.821  0.00  0.00    +0.204 A 
ATOM     31  N   LIG    1        0.470  -3.345  -2.002  0.00  0.00    -0.268 NA
ATOM     32  H   LIG    1        0.137  -3.236  -1.048  0.00  0.00    +0.190 HD
ATOM     33  N   LIG    1       -0.410  -3.126  -4.215  0.00  0.00    -0.320 N 
ATOM     34  C   LIG    1        0.821  -3.347  -4.931  0.00  0.00    +0.152 C 
ATOM     35  C   LIG    1       -1.607  -2.696  -4.764  0.00  0.00    +0.106 A 
ATOM     36  C   LIG    1       -2.454  -2.431  -3.761  0.00  0.00    +0.107 A 
ENDBRANCH  28  29
ENDBRANCH   5  28
TORSDOF 9