REMARK  Name = BDB062157
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.684   0.638   1.906  0.00  0.00    +0.097 A 
ATOM      2  C   LIG    1       -2.005   0.230   1.759  0.00  0.00    +0.077 A 
ATOM      3  N   LIG    1       -2.612   0.681   2.914  0.00  0.00    -0.333 N 
ATOM      4  C   LIG    1       -3.977   0.454   3.326  0.00  0.00    +0.150 C 
ATOM      5  C   LIG    1       -1.683   1.361   3.648  0.00  0.00    +0.200 A 
ATOM      6  N   LIG    1       -0.506   1.347   3.071  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   2   7
ATOM      7  C   LIG    1       -2.670  -0.563   0.719  0.00  0.00    +0.008 A 
ATOM      8  C   LIG    1       -3.631  -0.004  -0.171  0.00  0.00    -0.007 A 
ATOM      9  C   LIG    1       -4.258  -0.845  -1.133  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1       -5.221  -0.276  -2.004  0.00  0.00    +0.010 A 
ATOM     11  C   LIG    1       -5.556   1.076  -1.950  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -4.936   1.900  -1.027  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -3.894  -2.216  -1.187  0.00  0.00    +0.059 A 
ATOM     14  C   LIG    1       -2.935  -2.739  -0.313  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1       -3.987   1.367  -0.154  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1       -2.330  -1.919   0.631  0.00  0.00    +0.012 A 
BRANCH  13  17
ATOM     17  C   LIG    1       -4.487  -3.117  -2.136  0.00  0.00    +0.100 C 
ATOM     18  N   LIG    1       -4.968  -3.849  -2.898  0.00  0.00    -0.191 NA
ENDBRANCH  13  17
ENDBRANCH   2   7
BRANCH   1  21
ATOM     19  C   LIG    1       -0.383   2.101  -0.670  0.00  0.00    +0.044 C 
ATOM     20  C   LIG    1        0.554   1.010  -0.229  0.00  0.00    -0.041 A 
ATOM     21  C   LIG    1        0.412   0.329   1.000  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1        1.353  -0.662   1.367  0.00  0.00    -0.041 A 
ATOM     23  C   LIG    1        1.297  -1.357   2.702  0.00  0.00    +0.044 C 
ATOM     24  C   LIG    1        2.393  -0.988   0.480  0.00  0.00    +0.009 A 
ATOM     25  C   LIG    1        2.513  -0.356  -0.763  0.00  0.00    -0.033 A 
ATOM     26  C   LIG    1        1.594   0.643  -1.102  0.00  0.00    +0.009 A 
BRANCH  25  27
ATOM     27  C   LIG    1        3.637  -0.724  -1.701  0.00  0.00    +0.116 C 
BRANCH  27  28
ATOM     28  N   LIG    1        4.913  -0.212  -1.204  0.00  0.00    -0.311 NA
ATOM     29  H   LIG    1        4.833   0.802  -1.109  0.00  0.00    +0.122 HD
BRANCH  28  30
ATOM     30  C   LIG    1        5.996  -0.481  -2.161  0.00  0.00    +0.096 C 
BRANCH  30  31
ATOM     31  C   LIG    1        7.349   0.040  -1.638  0.00  0.00    +0.092 C 
BRANCH  31  32
ATOM     32  N   LIG    1        7.263   1.415  -1.129  0.00  0.00    -0.329 NA
ATOM     33  H   LIG    1        6.647   1.397  -0.313  0.00  0.00    +0.118 HD
ATOM     34  H   LIG    1        8.177   1.688  -0.769  0.00  0.00    +0.118 HD
ENDBRANCH  31  32
ENDBRANCH  30  31
ENDBRANCH  28  30
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   1  21
TORSDOF 8