REMARK  Name = BDB002356
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.002  -0.522   0.377  0.00  0.00    +0.234 C 
ATOM      2  N   LIG    1       -0.015  -1.139  -0.359  0.00  0.00    -0.302 N 
ATOM      3  H   LIG    1       -0.107  -1.216  -1.368  0.00  0.00    +0.150 HD
ATOM      4  O   LIG    1       -0.857  -0.277   1.573  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   1   5
ATOM      5  C   LIG    1       -2.311  -0.227  -0.406  0.00  0.00    +0.161 C 
BRANCH   5   6
ATOM      6  N   LIG    1       -3.428  -0.306   0.547  0.00  0.00    -0.302 N 
ATOM      7  H   LIG    1       -3.639  -1.239   0.880  0.00  0.00    +0.150 HD
ATOM      8  C   LIG    1       -3.751   0.714   1.425  0.00  0.00    +0.230 C 
ATOM      9  O   LIG    1       -3.298   1.853   1.358  0.00  0.00    -0.274 OA
BRANCH   8  10
ATOM     10  C   LIG    1       -4.769   0.299   2.513  0.00  0.00    +0.135 C 
ATOM     11  C   LIG    1       -6.138   0.034   1.899  0.00  0.00    +0.033 C 
BRANCH  10  12
ATOM     12  N   LIG    1       -4.881   1.364   3.530  0.00  0.00    -0.320 NA
ATOM     13  H   LIG    1       -5.106   2.232   3.035  0.00  0.00    +0.119 HD
ATOM     14  H   LIG    1       -3.937   1.544   3.883  0.00  0.00    +0.119 HD
ENDBRANCH  10  12
ENDBRANCH   8  10
ENDBRANCH   5   6
BRANCH   5  16
ATOM     15  C   LIG    1       -1.178   1.005  -2.357  0.00  0.00    +0.009 C 
ATOM     16  C   LIG    1       -2.269   1.053  -1.281  0.00  0.00    +0.012 C 
ATOM     17  C   LIG    1       -3.618   1.292  -1.976  0.00  0.00    +0.009 C 
ENDBRANCH   5  16
ENDBRANCH   1   5
BRANCH   2  18
ATOM     18  C   LIG    1        1.325  -1.378   0.173  0.00  0.00    +0.163 C 
BRANCH  18  19
ATOM     19  C   LIG    1        2.332  -1.008  -0.931  0.00  0.00    +0.250 C 
ATOM     20  N   LIG    1        3.640  -0.875  -0.493  0.00  0.00    -0.235 N 
ATOM     21  H   LIG    1        3.852  -0.709   0.487  0.00  0.00    +0.173 HD
ATOM     22  O   LIG    1        2.004  -0.878  -2.114  0.00  0.00    -0.272 OA
BRANCH  20  23
ATOM     23  N   LIG    1        4.572  -0.359  -1.429  0.00  0.00    -0.264 N 
ATOM     24  H   LIG    1        4.146  -0.374  -2.366  0.00  0.00    +0.170 HD
BRANCH  23  25
ATOM     25  C   LIG    1        4.950   0.966  -1.091  0.00  0.00    +0.044 A 
ATOM     26  C   LIG    1        4.519   2.048  -1.868  0.00  0.00    +0.024 A 
ATOM     27  C   LIG    1        4.863   3.355  -1.514  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1        5.640   3.590  -0.382  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        6.075   2.521   0.399  0.00  0.00    +0.002 A 
ATOM     30  C   LIG    1        5.729   1.214   0.047  0.00  0.00    +0.024 A 
ENDBRANCH  23  25
ENDBRANCH  20  23
ENDBRANCH  18  19
BRANCH  18  31
ATOM     31  C   LIG    1        1.534  -2.831   0.659  0.00  0.00    +0.012 C 
ATOM     32  C   LIG    1        1.220  -3.873  -0.420  0.00  0.00    +0.009 C 
ATOM     33  C   LIG    1        0.715  -3.130   1.919  0.00  0.00    +0.009 C 
ENDBRANCH  18  31
ENDBRANCH   2  18
TORSDOF 10