REMARK  Name = BDB032512
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.584  -0.382   1.690  0.00  0.00    -0.303 N 
ATOM      2  C   LIG    1       -1.099   0.688   2.574  0.00  0.00    +0.135 C 
ENDROOT
BRANCH   1  10
ATOM      3  C   LIG    1       -4.858   0.023  -0.077  0.00  0.00    +0.048 A 
ATOM      4  C   LIG    1       -5.789  -0.156   0.974  0.00  0.00    +0.012 A 
ATOM      5  C   LIG    1       -5.292  -0.381   2.273  0.00  0.00    -0.013 A 
ATOM      6  C   LIG    1       -6.191  -0.554   3.333  0.00  0.00    +0.028 A 
ATOM      7  C   LIG    1       -7.550  -0.506   3.076  0.00  0.00    +0.111 A 
ATOM      8  N   LIG    1       -8.070  -0.309   1.851  0.00  0.00    -0.263 NA
ATOM      9  C   LIG    1       -3.902  -0.443   2.487  0.00  0.00    +0.032 A 
ATOM     10  C   LIG    1       -2.979  -0.292   1.439  0.00  0.00    +0.035 A 
ATOM     11  C   LIG    1       -7.188  -0.153   0.835  0.00  0.00    +0.120 A 
ATOM     12  C   LIG    1       -3.478  -0.063   0.153  0.00  0.00    +0.037 A 
BRANCH   3  16
ATOM     13  C   LIG    1       -6.414   1.900  -2.943  0.00  0.00    +0.128 C 
ATOM     14  N   LIG    1       -6.054   1.435  -1.627  0.00  0.00    -0.314 N 
ATOM     15  H   LIG    1       -6.153   2.076  -0.850  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1       -5.277   0.308  -1.467  0.00  0.00    +0.245 C 
ATOM     17  O   LIG    1       -4.891  -0.408  -2.381  0.00  0.00    -0.270 OA
ENDBRANCH   3  16
ENDBRANCH   1  10
BRANCH   1  18
ATOM     18  C   LIG    1       -0.639  -0.990   0.823  0.00  0.00    +0.040 A 
ATOM     19  C   LIG    1        0.670  -0.527   0.656  0.00  0.00    +0.090 A 
ATOM     20  C   LIG    1        1.530  -1.197  -0.205  0.00  0.00    +0.216 A 
ATOM     21  N   LIG    1        1.192  -2.295  -0.906  0.00  0.00    -0.221 NA
ATOM     22  C   LIG    1       -0.066  -2.743  -0.735  0.00  0.00    +0.116 A 
ATOM     23  C   LIG    1       -0.993  -2.141   0.103  0.00  0.00    +0.043 A 
BRANCH  20  24
ATOM     24  O   LIG    1        2.802  -0.669  -0.319  0.00  0.00    -0.476 OA
BRANCH  24  25
ATOM     25  C   LIG    1        3.635  -1.390  -1.231  0.00  0.00    +0.234 C 
BRANCH  25  26
ATOM     26  C   LIG    1        5.021  -0.734  -1.297  0.00  0.00    +0.029 C 
ATOM     27  C   LIG    1        5.712  -0.700   0.070  0.00  0.00    +0.022 C 
ATOM     28  C   LIG    1        7.130  -0.119  -0.038  0.00  0.00    +0.084 C 
ATOM     29  N   LIG    1        7.285   0.871  -1.115  0.00  0.00    -0.305 NA
ATOM     30  C   LIG    1        8.416   1.756  -0.854  0.00  0.00    +0.104 C 
ATOM     31  C   LIG    1        6.051   1.620  -1.344  0.00  0.00    +0.084 C 
ATOM     32  C   LIG    1        4.955   0.691  -1.883  0.00  0.00    +0.022 C 
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  20  24
ENDBRANCH   1  18
TORSDOF 6