REMARK  Name = BDB063482
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.207  -0.126  -0.627  0.00  0.00    +0.204 A 
ATOM      2  N   LIG    1        0.758   0.105   0.325  0.00  0.00    -0.184 NA
ATOM      3  C   LIG    1        1.882   0.050  -0.363  0.00  0.00    +0.300 A 
ATOM      4  O   LIG    1        1.661  -0.204  -1.691  0.00  0.00    -0.329 OA
ATOM      5  N   LIG    1        0.284  -0.319  -1.861  0.00  0.00    -0.055 NA
ENDROOT
BRANCH   1   8
ATOM      6  C   LIG    1       -3.950  -0.407  -0.912  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1       -2.604  -0.390  -1.275  0.00  0.00    +0.014 A 
ATOM      8  C   LIG    1       -1.623  -0.155  -0.305  0.00  0.00    +0.041 A 
ATOM      9  C   LIG    1       -2.061   0.054   0.999  0.00  0.00    +0.122 A 
ATOM     10  N   LIG    1       -3.363   0.043   1.382  0.00  0.00    -0.263 NA
ATOM     11  C   LIG    1       -4.277  -0.187   0.416  0.00  0.00    +0.111 A 
ENDBRANCH   1   8
BRANCH   3  12
ATOM     12  C   LIG    1        3.317   0.246   0.236  0.00  0.00    +0.261 A 
ATOM     13  N   LIG    1        3.580   0.496   1.532  0.00  0.00    -0.128 NA
ATOM     14  N   LIG    1        4.918   0.570   1.487  0.00  0.00    -0.176 N 
ATOM     15  H   LIG    1        5.480   0.754   2.314  0.00  0.00    +0.214 HD
ATOM     16  N   LIG    1        5.477   0.387   0.284  0.00  0.00    -0.048 NA
ATOM     17  N   LIG    1        4.453   0.177  -0.532  0.00  0.00    -0.103 NA
ENDBRANCH   3  12
TORSDOF 2