REMARK  Name = BDB021723
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.327   1.166  -0.436  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1        2.569   0.517  -0.406  0.00  0.00    +0.307 C 
ATOM      3  N   LIG    1        2.504  -0.852  -0.270  0.00  0.00    -0.269 N 
ATOM      4  H   LIG    1        1.655  -1.277  -0.603  0.00  0.00    +0.156 HD
ATOM      5  O   LIG    1        3.622   1.142  -0.511  0.00  0.00    -0.252 OA
ENDROOT
BRANCH   3   6
ATOM      6  C   LIG    1        3.577  -1.736  -0.031  0.00  0.00    +0.038 A 
ATOM      7  C   LIG    1        4.842  -1.321   0.401  0.00  0.00    +0.036 A 
ATOM      8  C   LIG    1        5.871  -2.252   0.641  0.00  0.00    +0.059 A 
ATOM      9  C   LIG    1        5.616  -3.613   0.436  0.00  0.00    +0.050 A 
ATOM     10  C   LIG    1        4.355  -4.021   0.022  0.00  0.00    +0.126 A 
ATOM     11  F   LIG    1        4.113  -5.326  -0.161  0.00  0.00    -0.205 F 
ATOM     12  C   LIG    1        3.337  -3.101  -0.207  0.00  0.00    +0.061 A 
BRANCH   8  13
ATOM     13  C   LIG    1        7.234  -1.780   1.081  0.00  0.00    +0.418 C 
ATOM     14  F   LIG    1        7.995  -1.348   0.040  0.00  0.00    -0.166 F 
ATOM     15  F   LIG    1        7.962  -2.756   1.694  0.00  0.00    -0.166 F 
ATOM     16  F   LIG    1        7.182  -0.749   1.968  0.00  0.00    -0.166 F 
ENDBRANCH   8  13
ENDBRANCH   3   6
BRANCH   1  17
ATOM     17  C   LIG    1        0.018   0.522  -0.162  0.00  0.00    +0.080 C 
ATOM     18  C   LIG    1       -0.943   1.361   0.691  0.00  0.00    +0.038 C 
ATOM     19  C   LIG    1       -2.263   0.620   0.906  0.00  0.00    +0.086 C 
ATOM     20  N   LIG    1       -2.879   0.270  -0.381  0.00  0.00    -0.300 NA
ATOM     21  C   LIG    1       -2.004  -0.593  -1.181  0.00  0.00    +0.086 C 
ATOM     22  C   LIG    1       -0.669   0.097  -1.465  0.00  0.00    +0.038 C 
BRANCH  20  23
ATOM     23  C   LIG    1       -4.265  -0.230  -0.220  0.00  0.00    +0.054 C 
ATOM     24  C   LIG    1       -5.022  -0.061  -1.547  0.00  0.00    +0.024 C 
BRANCH  23  25
ATOM     25  C   LIG    1       -4.372  -1.674   0.324  0.00  0.00    +0.018 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -5.808  -2.083   0.670  0.00  0.00    -0.002 C 
ATOM     27  C   LIG    1       -5.852  -3.463   1.310  0.00  0.00    +0.004 C 
ENDBRANCH  25  26
ENDBRANCH  23  25
ENDBRANCH  20  23
ENDBRANCH   1  17
BRANCH   1  28
ATOM     28  C   LIG    1        1.348   2.583  -0.826  0.00  0.00    +0.109 C 
BRANCH  28  29
ATOM     29  C   LIG    1        1.668   3.515   0.349  0.00  0.00    +0.019 C 
BRANCH  29  31
ATOM     30  C   LIG    1        0.494   5.587  -0.564  0.00  0.00    +0.004 C 
ATOM     31  C   LIG    1        1.798   4.982  -0.067  0.00  0.00    -0.002 C 
ENDBRANCH  29  31
ENDBRANCH  28  29
ENDBRANCH   1  28
TORSDOF 9