REMARK  Name = BDB050750
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.257   0.702  -0.532  0.00  0.00    +0.075 A 
ATOM      2  C   LIG    1       -0.010   1.961  -1.065  0.00  0.00    +0.170 A 
ATOM      3  F   LIG    1        0.989   2.158  -1.936  0.00  0.00    -0.202 F 
ATOM      4  C   LIG    1       -0.783   3.034  -0.647  0.00  0.00    +0.159 A 
ATOM      5  F   LIG    1       -0.543   4.262  -1.127  0.00  0.00    -0.202 F 
ATOM      6  C   LIG    1       -1.807   2.861   0.286  0.00  0.00    +0.045 A 
ATOM      7  C   LIG    1       -2.080   1.588   0.812  0.00  0.00    -0.038 A 
ATOM      8  C   LIG    1       -1.282   0.507   0.404  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  10
ATOM      9  O   LIG    1        0.354  -0.841  -2.135  0.00  0.00    -0.270 OA
ATOM     10  C   LIG    1        0.540  -0.443  -0.990  0.00  0.00    +0.250 C 
ATOM     11  N   LIG    1        1.417  -1.039  -0.087  0.00  0.00    -0.294 N 
ATOM     12  C   LIG    1        2.258  -2.130  -0.586  0.00  0.00    +0.127 C 
ATOM     13  C   LIG    1        3.635  -1.600  -1.039  0.00  0.00    +0.124 C 
ATOM     14  N   LIG    1        4.278  -0.823   0.062  0.00  0.00    -0.327 N 
ATOM     15  C   LIG    1        3.412   0.258   0.595  0.00  0.00    +0.124 C 
ATOM     16  C   LIG    1        2.042  -0.311   1.027  0.00  0.00    +0.127 C 
BRANCH  14  17
ATOM     17  C   LIG    1        5.628  -0.519  -0.182  0.00  0.00    +0.033 A 
ATOM     18  C   LIG    1        6.554  -1.559  -0.335  0.00  0.00    +0.043 A 
ATOM     19  C   LIG    1        7.891  -1.265  -0.562  0.00  0.00    +0.112 A 
ATOM     20  N   LIG    1        8.379  -0.013  -0.647  0.00  0.00    -0.263 NA
ATOM     21  C   LIG    1        7.485   0.983  -0.488  0.00  0.00    +0.112 A 
ATOM     22  C   LIG    1        6.130   0.783  -0.253  0.00  0.00    +0.043 A 
ENDBRANCH  14  17
ENDBRANCH   1  10
BRANCH   7  23
ATOM     23  C   LIG    1       -3.178   1.414   1.839  0.00  0.00    +0.093 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.035   0.174   1.623  0.00  0.00    +0.074 A 
ATOM     25  C   LIG    1       -5.083   0.166   0.570  0.00  0.00    +0.011 A 
ATOM     26  C   LIG    1       -5.825  -1.004   0.421  0.00  0.00    +0.050 A 
ATOM     27  C   LIG    1       -6.829  -1.096  -0.550  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1       -7.090  -0.006  -1.379  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -6.352   1.168  -1.237  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1       -5.541  -2.151   1.300  0.00  0.00    +0.272 A 
ATOM     31  O   LIG    1       -6.174  -3.197   1.212  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1       -4.534  -1.975   2.216  0.00  0.00    -0.242 N 
ATOM     33  H   LIG    1       -4.327  -2.757   2.831  0.00  0.00    +0.192 HD
ATOM     34  C   LIG    1       -5.350   1.258  -0.265  0.00  0.00    +0.010 A 
ATOM     35  N   LIG    1       -3.791  -0.850   2.388  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   7  23
TORSDOF 4