REMARK  Name = BDB062507
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.326   1.054  -0.835  0.00  0.00    -0.018 A 
ATOM      2  C   LIG    1        1.023   0.565  -0.705  0.00  0.00    +0.053 A 
ATOM      3  C   LIG    1       -0.067   1.262  -1.237  0.00  0.00    +0.125 A 
ATOM      4  C   LIG    1        0.147   2.463  -1.918  0.00  0.00    +0.091 A 
ATOM      5  C   LIG    1        1.445   2.958  -2.071  0.00  0.00    +0.124 A 
ATOM      6  C   LIG    1        2.525   2.249  -1.534  0.00  0.00    +0.053 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1        4.535   0.807   0.275  0.00  0.00    +0.008 C 
ATOM      8  C   LIG    1        3.439   0.267  -0.283  0.00  0.00    +0.009 C 
BRANCH   7  12
ATOM      9  C   LIG    1        7.823  -1.411   1.909  0.00  0.00    +0.120 A 
ATOM     10  C   LIG    1        8.032  -0.230   1.196  0.00  0.00    +0.046 A 
ATOM     11  C   LIG    1        6.954   0.483   0.663  0.00  0.00    +0.011 A 
ATOM     12  C   LIG    1        5.645   0.017   0.825  0.00  0.00    -0.025 A 
ATOM     13  C   LIG    1        5.439  -1.160   1.555  0.00  0.00    +0.011 A 
ATOM     14  C   LIG    1        6.520  -1.873   2.090  0.00  0.00    +0.046 A 
BRANCH   9  16
ATOM     15  C   LIG    1        8.800  -3.221   3.101  0.00  0.00    +0.277 C 
ATOM     16  O   LIG    1        8.961  -2.008   2.376  0.00  0.00    -0.495 OA
ENDBRANCH   9  16
ENDBRANCH   7  12
ENDBRANCH   1   8
BRANCH   5  17
ATOM     17  O   LIG    1        1.794   4.111  -2.720  0.00  0.00    -0.495 OA
ATOM     18  C   LIG    1        0.743   4.887  -3.281  0.00  0.00    +0.277 C 
ENDBRANCH   5  17
BRANCH   3  19
ATOM     19  O   LIG    1       -1.278   0.662  -1.020  0.00  0.00    -0.487 OA
BRANCH  19  20
ATOM     20  C   LIG    1       -2.433   1.306  -1.548  0.00  0.00    +0.264 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -3.635   0.469  -1.188  0.00  0.00    -0.007 A 
ATOM     22  C   LIG    1       -4.261   0.623   0.055  0.00  0.00    +0.049 A 
ATOM     23  C   LIG    1       -5.362  -0.165   0.396  0.00  0.00    +0.165 A 
ATOM     24  F   LIG    1       -5.910   0.034   1.602  0.00  0.00    -0.202 F 
ATOM     25  C   LIG    1       -5.861  -1.126  -0.485  0.00  0.00    +0.157 A 
ATOM     26  C   LIG    1       -5.222  -1.292  -1.718  0.00  0.00    +0.049 A 
ATOM     27  C   LIG    1       -4.118  -0.507  -2.068  0.00  0.00    +0.011 A 
BRANCH  25  28
ATOM     28  O   LIG    1       -6.921  -1.967  -0.292  0.00  0.00    -0.475 OA
BRANCH  28  29
ATOM     29  C   LIG    1       -7.718  -1.818   0.880  0.00  0.00    +0.278 C 
ATOM     30  C   LIG    1       -9.040  -2.527   0.592  0.00  0.00    +0.064 C 
BRANCH  29  31
ATOM     31  C   LIG    1       -7.145  -2.422   2.164  0.00  0.00    +0.346 C 
ATOM     32  O   LIG    1       -7.611  -2.283   3.287  0.00  0.00    -0.247 OA
BRANCH  31  33
ATOM     33  O   LIG    1       -6.060  -3.202   1.981  0.00  0.00    -0.478 OA
ATOM     34  H   LIG    1       -5.822  -3.497   2.884  0.00  0.00    +0.295 HD
ENDBRANCH  31  33
ENDBRANCH  29  31
ENDBRANCH  28  29
ENDBRANCH  25  28
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 11