REMARK  Name = BDB031550
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.206   0.093  -2.073  0.00  0.00    -0.291 NA
ATOM      2  C   LIG    1       -0.598  -0.088  -0.823  0.00  0.00    +0.078 C 
ATOM      3  C   LIG    1        0.186  -0.796   0.268  0.00  0.00    +0.026 C 
ATOM      4  C   LIG    1       -1.549  -0.985  -1.665  0.00  0.00    +0.118 C 
ATOM      5  C   LIG    1       -1.038  -0.150  -2.859  0.00  0.00    +0.111 C 
ENDROOT
BRANCH   4   6
ATOM      6  N   LIG    1       -2.967  -0.836  -1.273  0.00  0.00    -0.340 N 
ATOM      7  C   LIG    1       -3.568  -1.652  -0.337  0.00  0.00    +0.068 A 
ATOM      8  C   LIG    1       -4.888  -1.215  -0.221  0.00  0.00    +0.090 A 
ATOM      9  N   LIG    1       -5.795  -1.775   0.614  0.00  0.00    -0.241 NA
ATOM     10  C   LIG    1       -5.315  -2.820   1.343  0.00  0.00    +0.126 A 
ATOM     11  C   LIG    1       -4.018  -3.319   1.287  0.00  0.00    +0.035 A 
ATOM     12  C   LIG    1       -5.066  -0.130  -1.109  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -3.099  -2.729   0.423  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1       -3.864   0.082  -1.752  0.00  0.00    +0.089 A 
BRANCH  10  15
ATOM     15  C   LIG    1       -6.301  -3.459   2.279  0.00  0.00    +0.262 C 
ATOM     16  N   LIG    1       -7.568  -2.915   2.230  0.00  0.00    -0.313 N 
ATOM     17  H   LIG    1       -7.678  -2.090   1.646  0.00  0.00    +0.149 HD
ATOM     18  C   LIG    1       -8.611  -3.307   3.139  0.00  0.00    +0.128 C 
ATOM     19  O   LIG    1       -5.978  -4.379   3.022  0.00  0.00    -0.269 OA
ENDBRANCH  10  15
ENDBRANCH   4   6
BRANCH   1  20
ATOM     20  C   LIG    1        0.642   1.487  -2.237  0.00  0.00    +0.121 C 
BRANCH  20  30
ATOM     21  C   LIG    1        6.370   2.135   0.799  0.00  0.00    +0.019 A 
ATOM     22  C   LIG    1        6.468   0.973  -0.146  0.00  0.00    +0.252 A 
ATOM     23  O   LIG    1        7.494   0.310  -0.254  0.00  0.00    -0.268 OA
ATOM     24  N   LIG    1        5.354   0.678  -0.890  0.00  0.00    -0.321 N 
ATOM     25  H   LIG    1        5.435  -0.107  -1.521  0.00  0.00    +0.169 HD
ATOM     26  C   LIG    1        4.156   1.395  -0.792  0.00  0.00    +0.068 A 
ATOM     27  C   LIG    1        4.056   2.466   0.093  0.00  0.00    +0.088 A 
ATOM     28  N   LIG    1        2.940   3.208   0.251  0.00  0.00    -0.253 NA
ATOM     29  C   LIG    1        1.876   2.857  -0.509  0.00  0.00    +0.116 A 
ATOM     30  C   LIG    1        1.871   1.802  -1.422  0.00  0.00    -0.013 A 
ATOM     31  C   LIG    1        3.051   1.060  -1.563  0.00  0.00    +0.034 A 
ATOM     32  C   LIG    1        5.216   2.819   0.903  0.00  0.00    +0.038 A 
BRANCH  21  34
ATOM     33  C   LIG    1        8.642   3.209   0.829  0.00  0.00    +0.009 C 
ATOM     34  C   LIG    1        7.585   2.455   1.624  0.00  0.00    +0.037 C 
ENDBRANCH  21  34
ENDBRANCH  20  30
ENDBRANCH   1  20
TORSDOF 5