REMARK  Name = BDB020190
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.751  -2.615   0.017  0.00  0.00    +0.150 C 
ATOM      2  N   LIG    1       -1.659  -1.202  -0.263  0.00  0.00    -0.331 N 
ATOM      3  C   LIG    1       -2.708  -0.314  -0.300  0.00  0.00    +0.069 A 
ATOM      4  C   LIG    1       -2.113   0.900  -0.629  0.00  0.00    +0.089 A 
ATOM      5  C   LIG    1       -2.908   2.048  -0.762  0.00  0.00    +0.030 A 
ATOM      6  C   LIG    1       -4.287   1.942  -0.554  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1       -4.864   0.715  -0.220  0.00  0.00    +0.002 A 
ATOM      8  N   LIG    1       -0.757   0.759  -0.777  0.00  0.00    -0.232 NA
ATOM      9  C   LIG    1       -4.087  -0.441  -0.086  0.00  0.00    +0.028 A 
ATOM     10  C   LIG    1       -0.497  -0.511  -0.537  0.00  0.00    +0.111 A 
ENDROOT
BRANCH  10  11
ATOM     11  C   LIG    1        0.856  -1.152  -0.568  0.00  0.00    +0.087 C 
BRANCH  11  12
ATOM     12  C   LIG    1        2.005  -0.134  -0.601  0.00  0.00    +0.083 C 
ATOM     13  C   LIG    1        3.321  -0.842  -0.875  0.00  0.00    +0.223 C 
ATOM     14  O   LIG    1        3.404  -2.003  -1.265  0.00  0.00    -0.275 OA
ATOM     15  N   LIG    1        4.454  -0.093  -0.669  0.00  0.00    -0.256 N 
ATOM     16  H   LIG    1        5.324  -0.574  -0.850  0.00  0.00    +0.157 HD
ATOM     17  C   LIG    1        4.564   0.980   0.179  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1        5.663   1.367   0.568  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1        3.277   1.657   0.579  0.00  0.00    +0.097 C 
ATOM     20  C   LIG    1        2.147   0.647   0.709  0.00  0.00    +0.022 C 
ENDBRANCH  11  12
ENDBRANCH  10  11
TORSDOF 2