REMARK  Name = BDB060764
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.765   1.785  -0.131  0.00  0.00    +0.220 A 
ATOM      2  N   LIG    1        2.660   0.802  -0.285  0.00  0.00    -0.214 NA
ATOM      3  C   LIG    1        3.967   1.135  -0.291  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        4.407   2.431  -0.163  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1        3.422   3.371  -0.015  0.00  0.00    +0.116 A 
ATOM      6  N   LIG    1        2.110   3.076   0.007  0.00  0.00    -0.223 NA
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1        4.902   0.033  -0.469  0.00  0.00    +0.027 A 
ATOM      8  C   LIG    1        6.198  -0.198   0.095  0.00  0.00    +0.028 A 
ATOM      9  C   LIG    1        6.658  -1.402  -0.431  0.00  0.00    +0.139 A 
ATOM     10  N   LIG    1        7.833  -2.012  -0.189  0.00  0.00    -0.237 NA
ATOM     11  C   LIG    1        8.609  -1.334   0.685  0.00  0.00    +0.113 A 
ATOM     12  C   LIG    1        8.278  -0.133   1.297  0.00  0.00    +0.020 A 
ATOM     13  N   LIG    1        5.694  -1.901  -1.259  0.00  0.00    -0.345 N 
ATOM     14  H   LIG    1        5.781  -2.776  -1.756  0.00  0.00    +0.167 HD
ATOM     15  C   LIG    1        7.047   0.458   1.007  0.00  0.00    +0.014 A 
ATOM     16  C   LIG    1        4.622  -1.051  -1.288  0.00  0.00    +0.095 A 
ENDBRANCH   3   7
BRANCH   1  17
ATOM     17  N   LIG    1        0.395   1.542  -0.113  0.00  0.00    -0.284 N 
ATOM     18  H   LIG    1       -0.089   2.418   0.010  0.00  0.00    +0.155 HD
BRANCH  17  21
ATOM     19  C   LIG    1       -2.670  -0.577  -0.226  0.00  0.00    +0.032 A 
ATOM     20  C   LIG    1       -1.794   0.522  -0.182  0.00  0.00    +0.046 A 
ATOM     21  C   LIG    1       -0.390   0.382  -0.152  0.00  0.00    +0.035 A 
ATOM     22  C   LIG    1        0.136  -0.909  -0.191  0.00  0.00    +0.023 A 
ATOM     23  C   LIG    1       -0.704  -2.020  -0.249  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -2.088  -1.851  -0.269  0.00  0.00    +0.023 A 
BRANCH  19  29
ATOM     25  C   LIG    1       -8.303   0.027   0.089  0.00  0.00    +0.105 C 
ATOM     26  N   LIG    1       -6.874   0.163   0.356  0.00  0.00    -0.302 NA
ATOM     27  C   LIG    1       -6.275  -1.154   0.671  0.00  0.00    +0.103 C 
ATOM     28  C   LIG    1       -4.746  -1.084   0.902  0.00  0.00    +0.120 C 
ATOM     29  N   LIG    1       -4.070  -0.459  -0.261  0.00  0.00    -0.327 N 
ATOM     30  C   LIG    1       -4.650   0.859  -0.594  0.00  0.00    +0.120 C 
ATOM     31  C   LIG    1       -6.176   0.738  -0.815  0.00  0.00    +0.103 C 
ENDBRANCH  19  29
ENDBRANCH  17  21
ENDBRANCH   1  17
TORSDOF 4