REMARK  Name = BDB000097
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.342   0.931  -0.800  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        1.611   0.520  -0.313  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1        1.644  -0.627   0.507  0.00  0.00    +0.073 A 
ATOM      4  C   LIG    1        2.866  -1.077   0.991  0.00  0.00    +0.028 A 
ATOM      5  C   LIG    1        4.064  -0.425   0.698  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1        4.048   0.710  -0.097  0.00  0.00    +0.001 A 
ATOM      7  N   LIG    1        0.544  -1.306   0.858  0.00  0.00    -0.251 NA
ATOM      8  C   LIG    1       -0.662  -0.869   0.426  0.00  0.00    +0.047 A 
ATOM      9  C   LIG    1       -1.846  -1.663   0.916  0.00  0.00    +0.056 C 
ATOM     10  C   LIG    1       -3.110  -1.428   0.097  0.00  0.00    +0.006 C 
ATOM     11  C   LIG    1       -3.343   0.065  -0.075  0.00  0.00    +0.005 C 
ATOM     12  C   LIG    1       -2.186   0.704  -0.843  0.00  0.00    +0.039 C 
ATOM     13  C   LIG    1        2.834   1.181  -0.598  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1       -0.820   0.265  -0.370  0.00  0.00    -0.005 A 
ENDROOT
BRANCH   1  15
ATOM     15  N   LIG    1        0.190   2.131  -1.546  0.00  0.00    -0.357 N 
ATOM     16  H   LIG    1        1.000   2.337  -2.122  0.00  0.00    +0.142 HD
ATOM     17  H   LIG    1        0.011   2.910  -0.915  0.00  0.00    +0.142 HD
ENDBRANCH   1  15
TORSDOF 1