REMARK  Name = BDB002332
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.514  -1.015   0.299  0.00  0.00    +0.234 C 
ATOM      2  N   LIG    1        0.131  -1.861   1.172  0.00  0.00    -0.302 N 
ATOM      3  H   LIG    1       -0.358  -2.122   2.022  0.00  0.00    +0.150 HD
ATOM      4  O   LIG    1        0.081  -0.394  -0.584  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   1   5
ATOM      5  C   LIG    1       -2.041  -0.911   0.497  0.00  0.00    +0.161 C 
BRANCH   5   7
ATOM      6  C   LIG    1       -3.364   1.187   0.357  0.00  0.00    +0.230 C 
ATOM      7  N   LIG    1       -2.496   0.277  -0.215  0.00  0.00    -0.302 N 
ATOM      8  H   LIG    1       -1.943   0.559  -1.018  0.00  0.00    +0.150 HD
ATOM      9  O   LIG    1       -3.884   0.989   1.452  0.00  0.00    -0.274 OA
BRANCH   6  10
ATOM     10  C   LIG    1       -3.587   2.449  -0.510  0.00  0.00    +0.137 C 
ATOM     11  C   LIG    1       -2.430   3.417  -0.267  0.00  0.00    +0.034 C 
BRANCH  10  13
ATOM     12  C   LIG    1       -6.016   2.328  -0.608  0.00  0.00    +0.101 C 
ATOM     13  N   LIG    1       -4.864   3.125  -0.209  0.00  0.00    -0.309 NA
ATOM     14  H   LIG    1       -4.896   4.023  -0.688  0.00  0.00    +0.122 HD
ENDBRANCH  10  13
ENDBRANCH   6  10
ENDBRANCH   5   7
BRANCH   5  15
ATOM     15  C   LIG    1       -2.756  -2.202   0.037  0.00  0.00    +0.012 C 
ATOM     16  C   LIG    1       -4.221  -2.218   0.480  0.00  0.00    +0.009 C 
ATOM     17  C   LIG    1       -2.670  -2.425  -1.476  0.00  0.00    +0.009 C 
ENDBRANCH   5  15
ENDBRANCH   1   5
BRANCH   2  18
ATOM     18  C   LIG    1        1.582  -2.086   1.162  0.00  0.00    +0.163 C 
BRANCH  18  19
ATOM     19  C   LIG    1        2.297  -0.816   1.668  0.00  0.00    +0.250 C 
ATOM     20  N   LIG    1        2.428   0.194   0.726  0.00  0.00    -0.235 N 
ATOM     21  H   LIG    1        1.711   0.243  -0.005  0.00  0.00    +0.173 HD
ATOM     22  O   LIG    1        2.660  -0.689   2.839  0.00  0.00    -0.272 OA
BRANCH  20  23
ATOM     23  N   LIG    1        2.850   1.448   1.218  0.00  0.00    -0.264 N 
ATOM     24  H   LIG    1        3.028   1.392   2.231  0.00  0.00    +0.170 HD
BRANCH  23  25
ATOM     25  C   LIG    1        3.984   1.964   0.539  0.00  0.00    +0.047 A 
ATOM     26  C   LIG    1        4.827   2.857   1.213  0.00  0.00    +0.062 A 
ATOM     27  C   LIG    1        5.905   3.440   0.553  0.00  0.00    +0.125 A 
ATOM     28  F   LIG    1        6.710   4.277   1.220  0.00  0.00    -0.205 F 
ATOM     29  C   LIG    1        6.157   3.176  -0.787  0.00  0.00    +0.038 A 
ATOM     30  C   LIG    1        5.305   2.324  -1.484  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1        4.219   1.734  -0.827  0.00  0.00    +0.024 A 
ENDBRANCH  23  25
ENDBRANCH  20  23
ENDBRANCH  18  19
BRANCH  18  32
ATOM     32  C   LIG    1        2.140  -2.649  -0.168  0.00  0.00    +0.012 C 
ATOM     33  C   LIG    1        3.638  -2.961  -0.049  0.00  0.00    +0.009 C 
ATOM     34  C   LIG    1        1.400  -3.926  -0.586  0.00  0.00    +0.009 C 
ENDBRANCH  18  32
ENDBRANCH   2  18
TORSDOF 10