REMARK  Name = BDB014152
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.885  -0.086   0.256  0.00  0.00    +0.091 A 
ATOM      2  N   LIG    1       -1.971  -0.912   1.330  0.00  0.00    -0.253 NA
ATOM      3  C   LIG    1       -3.176  -1.028   1.924  0.00  0.00    +0.112 A 
ATOM      4  C   LIG    1       -4.315  -0.367   1.496  0.00  0.00    +0.030 A 
ATOM      5  C   LIG    1       -4.218   0.468   0.384  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -2.977   0.619  -0.238  0.00  0.00    +0.040 A 
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1       -5.359   1.199  -0.126  0.00  0.00    +0.124 A 
ATOM      8  C   LIG    1       -6.652   0.753  -0.284  0.00  0.00    +0.166 A 
ATOM      9  N   LIG    1       -7.303   1.823  -0.823  0.00  0.00    -0.253 N 
ATOM     10  H   LIG    1       -8.275   1.915  -1.103  0.00  0.00    +0.191 HD
ATOM     11  N   LIG    1       -6.480   2.863  -0.997  0.00  0.00    -0.067 NA
ATOM     12  N   LIG    1       -5.277   2.489  -0.584  0.00  0.00    -0.129 NA
BRANCH   8  13
ATOM     13  C   LIG    1       -7.346  -0.504  -0.038  0.00  0.00    +0.436 C 
ATOM     14  F   LIG    1       -6.674  -1.574  -0.523  0.00  0.00    -0.164 F 
ATOM     15  F   LIG    1       -8.574  -0.512  -0.619  0.00  0.00    -0.164 F 
ATOM     16  F   LIG    1       -7.543  -0.719   1.285  0.00  0.00    -0.164 F 
ENDBRANCH   8  13
ENDBRANCH   5   7
BRANCH   1  19
ATOM     17  N   LIG    1        1.538  -0.177  -0.846  0.00  0.00    -0.336 N 
ATOM     18  C   LIG    1        0.578  -0.588   0.031  0.00  0.00    +0.117 A 
ATOM     19  C   LIG    1       -0.581   0.040  -0.381  0.00  0.00    +0.107 A 
ATOM     20  N   LIG    1       -0.330   0.813  -1.498  0.00  0.00    -0.234 NA
ATOM     21  C   LIG    1        0.950   0.656  -1.753  0.00  0.00    +0.200 A 
BRANCH  17  22
ATOM     22  C   LIG    1        2.934  -0.563  -0.828  0.00  0.00    +0.127 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.769   0.364   0.053  0.00  0.00    +0.057 C 
BRANCH  23  27
ATOM     24  F   LIG    1        7.489  -2.263   1.818  0.00  0.00    -0.205 F 
ATOM     25  C   LIG    1        7.042  -1.356   0.939  0.00  0.00    +0.124 A 
ATOM     26  C   LIG    1        5.702  -0.982   0.965  0.00  0.00    +0.042 A 
ATOM     27  C   LIG    1        5.224  -0.034   0.051  0.00  0.00    -0.043 A 
ATOM     28  C   LIG    1        6.113   0.517  -0.885  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        7.457   0.133  -0.901  0.00  0.00    +0.003 A 
ATOM     30  C   LIG    1        7.923  -0.807   0.015  0.00  0.00    +0.038 A 
ENDBRANCH  23  27
ENDBRANCH  22  23
ENDBRANCH  17  22
ENDBRANCH   1  19
TORSDOF 6