REMARK  Name = BDB002363
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.437   0.285  -0.836  0.00  0.00    +0.237 C 
ATOM      2  N   LIG    1        0.277   0.422  -2.008  0.00  0.00    -0.288 N 
ATOM      3  C   LIG    1        1.741   0.478  -1.963  0.00  0.00    +0.163 C 
ATOM      4  C   LIG    1        2.177   0.388  -3.429  0.00  0.00    +0.033 C 
ATOM      5  C   LIG    1        0.991  -0.270  -4.123  0.00  0.00    +0.021 C 
ATOM      6  C   LIG    1       -0.207   0.284  -3.368  0.00  0.00    +0.109 C 
ATOM      7  O   LIG    1        0.145   0.199   0.252  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1        2.229   1.807  -1.354  0.00  0.00    +0.250 C 
ATOM      9  N   LIG    1        3.514   1.845  -0.858  0.00  0.00    -0.235 N 
ATOM     10  H   LIG    1        3.824   2.695  -0.395  0.00  0.00    +0.173 HD
ATOM     11  O   LIG    1        1.553   2.839  -1.354  0.00  0.00    -0.272 OA
BRANCH   9  12
ATOM     12  N   LIG    1        4.326   0.712  -0.793  0.00  0.00    -0.264 N 
ATOM     13  H   LIG    1        5.218   0.848  -1.274  0.00  0.00    +0.170 HD
BRANCH  12  14
ATOM     14  C   LIG    1        4.510   0.197   0.517  0.00  0.00    +0.046 A 
ATOM     15  C   LIG    1        3.528   0.285   1.516  0.00  0.00    +0.046 A 
ATOM     16  C   LIG    1        3.717  -0.311   2.770  0.00  0.00    +0.061 A 
ATOM     17 CL   LIG    1        2.465  -0.128   3.948  0.00  0.00    -0.082 Cl
ATOM     18  C   LIG    1        4.886  -1.030   3.031  0.00  0.00    +0.059 A 
ATOM     19 CL   LIG    1        5.191  -1.792   4.551  0.00  0.00    -0.082 Cl
ATOM     20  C   LIG    1        5.852  -1.161   2.033  0.00  0.00    +0.023 A 
ATOM     21  C   LIG    1        5.657  -0.564   0.783  0.00  0.00    +0.026 A 
ENDBRANCH  12  14
ENDBRANCH   9  12
ENDBRANCH   3   8
BRANCH   1  22
ATOM     22  C   LIG    1       -1.983   0.319  -0.913  0.00  0.00    +0.162 C 
BRANCH  22  24
ATOM     23  C   LIG    1       -2.730  -1.607   0.448  0.00  0.00    +0.230 C 
ATOM     24  N   LIG    1       -2.511  -0.250   0.321  0.00  0.00    -0.302 N 
ATOM     25  H   LIG    1       -2.232   0.187   1.198  0.00  0.00    +0.150 HD
ATOM     26  O   LIG    1       -2.772  -2.371  -0.513  0.00  0.00    -0.274 OA
BRANCH  23  27
ATOM     27  C   LIG    1       -2.843  -2.079   1.922  0.00  0.00    +0.137 C 
ATOM     28  C   LIG    1       -3.758  -3.300   2.008  0.00  0.00    +0.034 C 
BRANCH  27  30
ATOM     29  C   LIG    1       -3.083  -1.187   4.186  0.00  0.00    +0.101 C 
ATOM     30  N   LIG    1       -3.307  -0.951   2.767  0.00  0.00    -0.309 NA
ATOM     31  H   LIG    1       -4.301  -0.795   2.594  0.00  0.00    +0.122 HD
ENDBRANCH  27  30
ENDBRANCH  23  27
ENDBRANCH  22  24
BRANCH  22  32
ATOM     32  C   LIG    1       -2.501   1.754  -1.166  0.00  0.00    +0.012 C 
ATOM     33  C   LIG    1       -4.008   1.746  -1.442  0.00  0.00    +0.009 C 
ATOM     34  C   LIG    1       -2.188   2.726  -0.023  0.00  0.00    +0.009 C 
ENDBRANCH  22  32
ENDBRANCH   1  22
TORSDOF 8