REMARK  Name = BDB051151
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        3.116   1.385   1.883  0.00  0.00    -0.490 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        4.240   1.178   1.135  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1        4.288   0.777  -0.199  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1        5.520   0.606  -0.840  0.00  0.00    +0.007 A 
ATOM      5  C   LIG    1        6.721   0.836  -0.155  0.00  0.00    -0.042 A 
ATOM      6  C   LIG    1        6.669   1.243   1.183  0.00  0.00    +0.007 A 
ATOM      7  C   LIG    1        5.436   1.411   1.818  0.00  0.00    +0.046 A 
BRANCH   5   8
ATOM      8  C   LIG    1        8.048   0.610  -0.837  0.00  0.00    +0.083 C 
BRANCH   8   9
ATOM      9  C   LIG    1        8.586  -0.793  -0.822  0.00  0.00    +0.058 A 
ATOM     10  C   LIG    1        8.171  -1.939  -0.248  0.00  0.00    +0.204 A 
ATOM     11  N   LIG    1        8.964  -3.016  -0.494  0.00  0.00    -0.287 N 
ATOM     12  H   LIG    1        8.756  -3.928  -0.117  0.00  0.00    +0.172 HD
ATOM     13  C   LIG    1       10.065  -2.809  -1.277  0.00  0.00    +0.291 A 
ATOM     14  O   LIG    1       10.898  -3.630  -1.617  0.00  0.00    -0.260 OA
ATOM     15  S   LIG    1       10.078  -1.104  -1.729  0.00  0.00    -0.028 S 
BRANCH  10  16
ATOM     16  O   LIG    1        7.094  -2.191   0.535  0.00  0.00    -0.493 OA
ATOM     17  H   LIG    1        6.593  -1.371   0.676  0.00  0.00    +0.294 HD
ENDBRANCH  10  16
ENDBRANCH   8   9
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1        1.837   1.127   1.296  0.00  0.00    +0.247 C 
BRANCH  18  19
ATOM     19  C   LIG    1        1.322   2.362   0.550  0.00  0.00    +0.145 C 
BRANCH  19  21
ATOM     20  C   LIG    1       -1.067   1.798   0.267  0.00  0.00    +0.213 C 
ATOM     21  N   LIG    1        0.161   2.101  -0.284  0.00  0.00    -0.312 N 
ATOM     22  H   LIG    1        0.190   2.408  -1.248  0.00  0.00    +0.149 HD
ATOM     23  O   LIG    1       -1.240   1.625   1.467  0.00  0.00    -0.276 OA
BRANCH  20  24
ATOM     24  C   LIG    1       -2.167   1.692  -0.772  0.00  0.00    +0.096 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -3.517   1.333  -0.152  0.00  0.00    +0.009 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -4.607   1.227  -1.220  0.00  0.00    +0.000 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -6.004   0.982  -0.643  0.00  0.00    +0.000 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -6.147  -0.377   0.049  0.00  0.00    +0.000 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -7.591  -0.618   0.497  0.00  0.00    -0.000 C 
BRANCH  29  30
ATOM     30  C   LIG    1       -7.772  -1.909   1.302  0.00  0.00    -0.000 C 
BRANCH  30  32
ATOM     31  C   LIG    1       -8.193  -3.443  -0.694  0.00  0.00    +0.004 C 
ATOM     32  C   LIG    1       -7.394  -3.203   0.577  0.00  0.00    -0.003 C 
ENDBRANCH  30  32
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  20  24
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 15