REMARK  Name = BDB032927
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.178  -0.640  -0.902  0.00  0.00    +0.040 A 
ATOM      2  C   LIG    1        1.077   0.437  -1.027  0.00  0.00    -0.035 A 
ATOM      3  C   LIG    1        1.205   1.056  -2.281  0.00  0.00    +0.004 A 
ATOM      4  C   LIG    1        0.464   0.610  -3.379  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -0.411  -0.466  -3.245  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -0.551  -1.098  -2.011  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1       -1.292  -2.402   2.135  0.00  0.00    +0.140 C 
ATOM      8  N   LIG    1       -1.176  -1.401   1.079  0.00  0.00    -0.249 N 
ATOM      9  C   LIG    1        0.038  -1.385   0.371  0.00  0.00    +0.252 C 
ATOM     10  O   LIG    1        1.027  -2.037   0.715  0.00  0.00    -0.270 OA
BRANCH   8  11
ATOM     11  C   LIG    1       -2.119  -0.385   0.887  0.00  0.00    +0.169 A 
ATOM     12  S   LIG    1       -3.609  -0.474   1.748  0.00  0.00    -0.029 S 
ATOM     13  C   LIG    1       -4.110   0.984   1.033  0.00  0.00    +0.166 A 
ATOM     14  C   LIG    1       -3.130   1.460   0.198  0.00  0.00    +0.152 A 
ATOM     15  N   LIG    1       -1.992   0.677   0.123  0.00  0.00    -0.231 NA
BRANCH  13  16
ATOM     16  N   LIG    1       -5.389   1.677   1.243  0.00  0.00    -0.022 NA
ATOM     17  O   LIG    1       -6.170   1.112   2.017  0.00  0.00    -0.143 OA
ENDBRANCH  13  16
ENDBRANCH   8  11
ENDBRANCH   1   9
BRANCH   2  18
ATOM     18  C   LIG    1        1.906   0.940   0.132  0.00  0.00    +0.044 C 
BRANCH  18  19
ATOM     19  C   LIG    1        3.300   0.319   0.146  0.00  0.00    +0.118 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.102   0.831   1.317  0.00  0.00    +0.390 C 
ATOM     21  F   LIG    1        3.510   0.545   2.495  0.00  0.00    -0.171 F 
ATOM     22  F   LIG    1        5.336   0.281   1.331  0.00  0.00    -0.171 F 
ATOM     23  F   LIG    1        4.257   2.172   1.249  0.00  0.00    -0.171 F 
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   2  18
TORSDOF 6