REMARK  Name = BDB012610
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.703   0.756  -0.980  0.00  0.00    -0.336 N 
ATOM      2  C   LIG    1        0.475   0.102  -0.738  0.00  0.00    +0.117 A 
ATOM      3  C   LIG    1        1.468   0.979  -1.136  0.00  0.00    +0.107 A 
ATOM      4  N   LIG    1        0.893   2.139  -1.623  0.00  0.00    -0.234 NA
ATOM      5  C   LIG    1       -0.404   1.967  -1.530  0.00  0.00    +0.200 A 
ENDROOT
BRANCH   3   6
ATOM      6  C   LIG    1        2.911   0.750  -1.062  0.00  0.00    +0.091 A 
ATOM      7  N   LIG    1        3.699   1.837  -1.246  0.00  0.00    -0.253 NA
ATOM      8  C   LIG    1        5.033   1.664  -1.184  0.00  0.00    +0.112 A 
ATOM      9  C   LIG    1        5.642   0.446  -0.943  0.00  0.00    +0.030 A 
ATOM     10  C   LIG    1        4.833  -0.674  -0.754  0.00  0.00    +0.007 A 
ATOM     11  C   LIG    1        3.443  -0.512  -0.816  0.00  0.00    +0.040 A 
BRANCH  10  12
ATOM     12  C   LIG    1        5.386  -1.992  -0.496  0.00  0.00    +0.112 A 
ATOM     13  N   LIG    1        4.619  -3.104  -0.251  0.00  0.00    -0.130 NA
ATOM     14  N   LIG    1        5.428  -4.137  -0.057  0.00  0.00    -0.068 NA
ATOM     15  N   LIG    1        6.684  -3.688  -0.178  0.00  0.00    -0.264 N 
ATOM     16  H   LIG    1        7.449  -4.343  -0.062  0.00  0.00    +0.190 HD
ATOM     17  C   LIG    1        6.715  -2.352  -0.451  0.00  0.00    +0.135 A 
ENDBRANCH  10  12
ENDBRANCH   3   6
BRANCH   1  18
ATOM     18  C   LIG    1       -2.034   0.244  -0.723  0.00  0.00    +0.131 C 
BRANCH  18  25
ATOM     19  C   LIG    1       -6.292  -1.619   1.237  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1       -6.138  -0.240   1.377  0.00  0.00    +0.046 A 
ATOM     21  C   LIG    1       -4.882   0.348   1.224  0.00  0.00    +0.124 A 
ATOM     22  O   LIG    1       -4.839   1.703   1.407  0.00  0.00    -0.492 OA
ATOM     23  C   LIG    1       -3.613   2.347   1.062  0.00  0.00    +0.230 C 
ATOM     24  C   LIG    1       -2.390   1.543   1.474  0.00  0.00    +0.051 C 
ATOM     25  C   LIG    1       -2.394   0.179   0.775  0.00  0.00    +0.045 C 
ATOM     26  C   LIG    1       -3.762  -0.443   0.940  0.00  0.00    -0.001 A 
ATOM     27  C   LIG    1       -3.926  -1.832   0.806  0.00  0.00    +0.007 A 
ATOM     28  C   LIG    1       -5.186  -2.414   0.951  0.00  0.00    +0.001 A 
ENDBRANCH  18  25
ENDBRANCH   1  18
TORSDOF 4