REMARK  Name = BDB018909
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        6.579  -1.267   0.985  0.00  0.00    +0.129 C 
ATOM      2  N   LIG    1        5.362  -0.810   0.359  0.00  0.00    -0.302 N 
ATOM      3  H   LIG    1        5.471  -0.048  -0.290  0.00  0.00    +0.150 HD
ATOM      4  C   LIG    1        4.210  -0.739   1.104  0.00  0.00    +0.302 C 
ATOM      5  N   LIG    1        3.107  -0.258   0.426  0.00  0.00    -0.278 N 
ATOM      6  C   LIG    1        1.902  -0.019   1.218  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1        0.786   0.739   0.534  0.00  0.00    +0.012 A 
ATOM      8  C   LIG    1        1.026   1.829  -0.312  0.00  0.00    +0.125 A 
ATOM      9  C   LIG    1       -0.025   2.561  -0.862  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1       -1.343   2.191  -0.598  0.00  0.00    +0.012 A 
ATOM     11  C   LIG    1       -1.623   1.097   0.234  0.00  0.00    -0.015 A 
ATOM     12  O   LIG    1        2.294   2.262  -0.576  0.00  0.00    -0.490 OA
ATOM     13  C   LIG    1        3.017   1.371  -1.439  0.00  0.00    +0.248 C 
ATOM     14  C   LIG    1       -0.549   0.388   0.801  0.00  0.00    +0.017 A 
ATOM     15  C   LIG    1        3.006  -0.105  -1.025  0.00  0.00    +0.150 C 
ATOM     16  O   LIG    1        4.170  -1.080   2.283  0.00  0.00    -0.253 OA
ENDROOT
BRANCH  11  17
ATOM     17  C   LIG    1       -3.010   0.713   0.523  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1       -3.691  -0.322  -0.170  0.00  0.00    -0.007 A 
ATOM     19  C   LIG    1       -5.025  -0.616   0.195  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -5.736  -1.635  -0.465  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1       -5.140  -2.370  -1.489  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1       -3.831  -2.093  -1.864  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1       -5.604   0.133   1.220  0.00  0.00    +0.119 A 
ATOM     24  N   LIG    1       -4.983   1.125   1.894  0.00  0.00    -0.262 NA
ATOM     25  C   LIG    1       -3.116  -1.083  -1.215  0.00  0.00    +0.009 A 
ATOM     26  C   LIG    1       -3.709   1.385   1.530  0.00  0.00    +0.119 A 
ENDBRANCH  11  17
TORSDOF 1