REMARK  Name = BDB061767
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.450  -1.317   1.931  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.631  -1.627   3.274  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        0.044  -2.630   3.852  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -1.495  -0.865   4.054  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -2.191   0.205   3.484  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -2.042   0.514   2.120  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1       -1.154  -0.255   1.349  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  13
ATOM      8  N   LIG    1        3.991  -0.346  -0.762  0.00  0.00    -0.297 NA
ATOM      9  C   LIG    1        3.582  -0.033   0.634  0.00  0.00    +0.071 C 
ATOM     10  C   LIG    1        4.068   1.312   1.187  0.00  0.00    +0.026 C 
ATOM     11  C   LIG    1        2.060  -0.189   0.889  0.00  0.00    +0.126 C 
ATOM     12  N   LIG    1        1.572  -1.533   0.552  0.00  0.00    -0.295 N 
ATOM     13  C   LIG    1        0.454  -2.139   1.110  0.00  0.00    +0.249 C 
ATOM     14  O   LIG    1        0.151  -3.315   0.926  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1        2.433  -2.320  -0.330  0.00  0.00    +0.123 C 
ATOM     16  C   LIG    1        3.152  -1.422  -1.351  0.00  0.00    +0.103 C 
BRANCH   8  17
ATOM     17  C   LIG    1        4.087   0.812  -1.664  0.00  0.00    +0.084 C 
BRANCH  17  19
ATOM     18  C   LIG    1        6.079  -0.061  -3.001  0.00  0.00    +0.005 C 
ATOM     19  C   LIG    1        4.664   0.499  -3.054  0.00  0.00    +0.012 C 
ENDBRANCH  17  19
ENDBRANCH   8  17
ENDBRANCH   1  13
BRANCH   6  20
ATOM     20  C   LIG    1       -2.782   1.700   1.532  0.00  0.00    +0.162 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.288   1.484   0.175  0.00  0.00    -0.289 N 
ATOM     22  C   LIG    1       -4.467   0.711  -0.059  0.00  0.00    +0.059 A 
ATOM     23  C   LIG    1       -4.927   0.536  -1.370  0.00  0.00    +0.063 A 
ATOM     24  C   LIG    1       -6.077  -0.215  -1.650  0.00  0.00    +0.015 A 
ATOM     25  C   LIG    1       -6.787  -0.807  -0.611  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1       -6.346  -0.647   0.700  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1       -4.184   1.155  -2.478  0.00  0.00    +0.262 A 
ATOM     28  O   LIG    1       -4.541   1.042  -3.645  0.00  0.00    -0.267 OA
ATOM     29  N   LIG    1       -3.069   1.864  -2.129  0.00  0.00    -0.274 N 
ATOM     30  H   LIG    1       -2.544   2.280  -2.883  0.00  0.00    +0.173 HD
ATOM     31  C   LIG    1       -5.197   0.105   0.974  0.00  0.00    +0.027 A 
ATOM     32  C   LIG    1       -2.573   2.049  -0.871  0.00  0.00    +0.330 A 
ATOM     33  O   LIG    1       -1.531   2.686  -0.725  0.00  0.00    -0.246 OA
ENDBRANCH  20  21
ENDBRANCH   6  20
TORSDOF 5