REMARK  Name = BDB061766
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.792   0.580  -0.050  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.730   1.660  -0.924  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -1.594   2.680  -0.822  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.230   1.693  -1.929  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        1.155   0.651  -2.042  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1        1.140  -0.424  -1.137  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1        0.146  -0.456  -0.146  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  15
ATOM      8  C   LIG    1       -6.401   0.227   2.742  0.00  0.00    +0.025 C 
ATOM      9  C   LIG    1       -5.380  -0.160   1.675  0.00  0.00    +0.068 C 
ATOM     10  N   LIG    1       -5.991   0.015   0.340  0.00  0.00    -0.311 NA
ATOM     11  H   LIG    1       -6.801  -0.598   0.257  0.00  0.00    +0.122 HD
ATOM     12  C   LIG    1       -5.012  -0.326  -0.702  0.00  0.00    +0.100 C 
ATOM     13  C   LIG    1       -3.710   0.488  -0.597  0.00  0.00    +0.123 C 
ATOM     14  N   LIG    1       -3.131   0.438   0.751  0.00  0.00    -0.295 N 
ATOM     15  C   LIG    1       -1.775   0.537   1.044  0.00  0.00    +0.249 C 
ATOM     16  O   LIG    1       -1.322   0.534   2.188  0.00  0.00    -0.270 OA
ATOM     17  C   LIG    1       -4.086   0.669   1.839  0.00  0.00    +0.126 C 
ENDBRANCH   1  15
BRANCH   6  18
ATOM     18  C   LIG    1        2.148  -1.553  -1.239  0.00  0.00    +0.162 C 
BRANCH  18  19
ATOM     19  N   LIG    1        3.539  -1.100  -1.304  0.00  0.00    -0.289 N 
ATOM     20  C   LIG    1        4.230  -0.654  -0.135  0.00  0.00    +0.059 A 
ATOM     21  C   LIG    1        5.554  -0.213  -0.241  0.00  0.00    +0.063 A 
ATOM     22  C   LIG    1        6.272   0.239   0.875  0.00  0.00    +0.015 A 
ATOM     23  C   LIG    1        5.665   0.256   2.127  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1        4.349  -0.179   2.256  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1        6.209  -0.226  -1.558  0.00  0.00    +0.262 A 
ATOM     26  O   LIG    1        7.362   0.158  -1.716  0.00  0.00    -0.267 OA
ATOM     27  N   LIG    1        5.454  -0.691  -2.597  0.00  0.00    -0.274 N 
ATOM     28  H   LIG    1        5.889  -0.694  -3.507  0.00  0.00    +0.173 HD
ATOM     29  C   LIG    1        3.639  -0.632   1.137  0.00  0.00    +0.027 A 
ATOM     30  C   LIG    1        4.155  -1.107  -2.547  0.00  0.00    +0.330 A 
ATOM     31  O   LIG    1        3.598  -1.452  -3.589  0.00  0.00    -0.246 OA
ENDBRANCH  18  19
ENDBRANCH   6  18
TORSDOF 3