REMARK  Name = BDB018911
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -6.754  -0.088   1.548  0.00  0.00    +0.129 C 
ATOM      2  N   LIG    1       -5.584   0.114   0.727  0.00  0.00    -0.302 N 
ATOM      3  H   LIG    1       -5.691  -0.132  -0.244  0.00  0.00    +0.150 HD
ATOM      4  C   LIG    1       -4.346  -0.186   1.239  0.00  0.00    +0.302 C 
ATOM      5  N   LIG    1       -3.294   0.007   0.365  0.00  0.00    -0.278 N 
ATOM      6  C   LIG    1       -1.976  -0.443   0.811  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -0.888  -0.484  -0.239  0.00  0.00    +0.012 A 
ATOM      8  C   LIG    1       -1.124  -0.902  -1.553  0.00  0.00    +0.125 A 
ATOM      9  C   LIG    1       -0.083  -1.008  -2.473  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1        1.215  -0.660  -2.097  0.00  0.00    +0.012 A 
ATOM     11  C   LIG    1        1.495  -0.224  -0.793  0.00  0.00    -0.017 A 
ATOM     12  O   LIG    1       -2.367  -1.289  -1.968  0.00  0.00    -0.490 OA
ATOM     13  C   LIG    1       -3.273  -0.185  -2.104  0.00  0.00    +0.248 C 
ATOM     14  C   LIG    1        0.430  -0.151   0.125  0.00  0.00    +0.017 A 
ATOM     15  C   LIG    1       -3.363   0.750  -0.893  0.00  0.00    +0.150 C 
ATOM     16  O   LIG    1       -4.192  -0.594   2.387  0.00  0.00    -0.253 OA
ENDROOT
BRANCH  11  17
ATOM     17  C   LIG    1        2.866   0.135  -0.392  0.00  0.00    -0.017 A 
ATOM     18  C   LIG    1        3.475  -0.486   0.716  0.00  0.00    +0.018 A 
ATOM     19  C   LIG    1        4.787  -0.138   1.097  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        5.466   0.829   0.358  0.00  0.00    +0.046 A 
ATOM     21  N   LIG    1        6.708   0.980   0.932  0.00  0.00    -0.361 N 
ATOM     22  H   LIG    1        7.418   1.619   0.603  0.00  0.00    +0.165 HD
ATOM     23  C   LIG    1        6.838   0.140   2.006  0.00  0.00    +0.083 A 
ATOM     24  C   LIG    1        4.897   1.468  -0.747  0.00  0.00    +0.027 A 
ATOM     25  C   LIG    1        5.663  -0.566   2.133  0.00  0.00    +0.027 A 
ATOM     26  C   LIG    1        3.592   1.103  -1.104  0.00  0.00    +0.010 A 
ENDBRANCH  11  17
TORSDOF 1