REMARK  Name = BDB026629
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.800   0.086  -0.363  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -0.157  -0.730  -0.967  0.00  0.00    +0.036 A 
ATOM      3  C   LIG    1       -1.521  -0.664  -0.600  0.00  0.00    +0.064 A 
ATOM      4  C   LIG    1       -1.927   0.247   0.396  0.00  0.00    -0.006 A 
ATOM      5  C   LIG    1       -0.955   1.063   0.998  0.00  0.00    +0.011 A 
ATOM      6  C   LIG    1        0.389   0.984   0.623  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.323   0.378   0.830  0.00  0.00    -0.017 A 
ATOM      8  C   LIG    1       -3.795  -0.330   1.946  0.00  0.00    +0.008 A 
ATOM      9  C   LIG    1       -5.121  -0.200   2.364  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -5.990   0.642   1.674  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1       -5.536   1.355   0.567  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -4.210   1.225   0.148  0.00  0.00    +0.008 A 
ENDBRANCH   4   7
BRANCH   1  15
ATOM     13  O   LIG    1        2.303  -1.646  -2.245  0.00  0.00    -0.274 OA
ATOM     14  C   LIG    1        2.831  -0.765  -1.570  0.00  0.00    +0.237 C 
ATOM     15  N   LIG    1        2.175   0.075  -0.684  0.00  0.00    -0.284 N 
ATOM     16  H   LIG    1        2.743   0.729  -0.155  0.00  0.00    +0.155 HD
BRANCH  14  17
ATOM     17  C   LIG    1        4.315  -0.485  -1.740  0.00  0.00    +0.218 C 
BRANCH  17  18
ATOM     18  N   LIG    1        4.999  -0.178  -0.499  0.00  0.00    -0.328 N 
ATOM     19  C   LIG    1        5.176  -1.035   0.549  0.00  0.00    +0.199 A 
ATOM     20  N   LIG    1        5.791  -0.441   1.546  0.00  0.00    -0.244 NA
ATOM     21  C   LIG    1        6.051   0.833   1.111  0.00  0.00    +0.130 A 
ATOM     22  C   LIG    1        5.564   1.020  -0.161  0.00  0.00    +0.107 A 
ENDBRANCH  17  18
ENDBRANCH  14  17
ENDBRANCH   1  15
BRANCH   3  23
ATOM     23  C   LIG    1       -2.517  -1.572  -1.289  0.00  0.00    +0.418 C 
ATOM     24  F   LIG    1       -3.192  -2.381  -0.426  0.00  0.00    -0.166 F 
ATOM     25  F   LIG    1       -1.941  -2.418  -2.193  0.00  0.00    -0.166 F 
ATOM     26  F   LIG    1       -3.459  -0.887  -1.995  0.00  0.00    -0.166 F 
ENDBRANCH   3  23
TORSDOF 5