REMARK  Name = BDB064284
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.139  -1.508  -1.840  0.00  0.00    +0.055 A 
ATOM      2  C   LIG    1        1.053  -2.885  -1.934  0.00  0.00    +0.126 A 
ATOM      3  N   LIG    1       -0.019  -3.603  -1.511  0.00  0.00    -0.239 NA
ATOM      4  C   LIG    1       -1.080  -2.936  -0.999  0.00  0.00    +0.125 A 
ATOM      5  C   LIG    1       -1.074  -1.546  -0.906  0.00  0.00    +0.044 A 
ATOM      6  C   LIG    1        0.041  -0.822  -1.337  0.00  0.00    +0.018 A 
ENDROOT
BRANCH   1  11
ATOM      7  N   LIG    1        4.510   2.089   0.087  0.00  0.00    -0.297 NA
ATOM      8  C   LIG    1        4.359   2.205  -1.378  0.00  0.00    +0.103 C 
ATOM      9  C   LIG    1        4.086   0.882  -2.116  0.00  0.00    +0.123 C 
ATOM     10  N   LIG    1        2.949   0.153  -1.554  0.00  0.00    -0.295 N 
ATOM     11  C   LIG    1        2.350  -0.828  -2.336  0.00  0.00    +0.248 C 
ATOM     12  O   LIG    1        2.781  -1.164  -3.437  0.00  0.00    -0.270 OA
ATOM     13  C   LIG    1        2.721   0.336  -0.114  0.00  0.00    +0.123 C 
ATOM     14  C   LIG    1        3.990   0.818   0.620  0.00  0.00    +0.103 C 
BRANCH   7  16
ATOM     15  C   LIG    1        6.985   1.560   0.161  0.00  0.00    +0.024 C 
ATOM     16  C   LIG    1        5.839   2.490   0.579  0.00  0.00    +0.051 C 
ATOM     17  C   LIG    1        5.842   2.674   2.101  0.00  0.00    +0.024 C 
ENDBRANCH   7  16
ENDBRANCH   1  11
BRANCH   4  18
ATOM     18  N   LIG    1       -2.128  -3.739  -0.593  0.00  0.00    -0.268 N 
ATOM     19  H   LIG    1       -1.949  -4.720  -0.733  0.00  0.00    +0.156 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -3.383  -3.510  -0.059  0.00  0.00    +0.221 A 
ATOM     21  N   LIG    1       -3.834  -2.268   0.167  0.00  0.00    -0.214 NA
ATOM     22  C   LIG    1       -5.069  -2.114   0.696  0.00  0.00    +0.076 A 
ATOM     23  C   LIG    1       -5.868  -3.197   0.996  0.00  0.00    +0.048 A 
ATOM     24  C   LIG    1       -5.331  -4.430   0.729  0.00  0.00    +0.116 A 
ATOM     25  N   LIG    1       -4.104  -4.608   0.210  0.00  0.00    -0.223 NA
BRANCH  22  26
ATOM     26  C   LIG    1       -5.495  -0.716   0.913  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1       -5.111   0.289   0.001  0.00  0.00    +0.027 A 
ATOM     28  C   LIG    1       -5.518   1.618   0.214  0.00  0.00    +0.040 A 
ATOM     29  C   LIG    1       -6.298   1.982   1.312  0.00  0.00    +0.078 A 
ATOM     30  N   LIG    1       -6.624   3.326   1.392  0.00  0.00    -0.247 NA
ATOM     31  C   LIG    1       -6.099   3.964   0.371  0.00  0.00    +0.157 A 
ATOM     32  C   LIG    1       -6.678   0.984   2.227  0.00  0.00    +0.029 A 
ATOM     33  S   LIG    1       -5.195   3.021  -0.735  0.00  0.00    -0.075 S 
ATOM     34  C   LIG    1       -6.274  -0.344   2.021  0.00  0.00    +0.012 A 
ENDBRANCH  22  26
ENDBRANCH  18  20
ENDBRANCH   4  18
TORSDOF 5