REMARK  Name = BDB064211
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.377  -0.078  -0.106  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1        0.523  -1.137   0.784  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1        1.528  -2.016   0.655  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1       -0.368  -1.297   1.840  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1       -1.435  -0.407   1.991  0.00  0.00    +0.008 A 
ATOM      6  C   LIG    1       -1.631   0.640   1.075  0.00  0.00    -0.027 A 
ATOM      7  C   LIG    1       -0.705   0.803   0.031  0.00  0.00    +0.021 A 
ENDROOT
BRANCH   1  13
ATOM      8  N   LIG    1        5.470  -0.347  -0.846  0.00  0.00    -0.299 N 
ATOM      9  C   LIG    1        4.985  -0.104  -2.128  0.00  0.00    +0.233 C 
ATOM     10  O   LIG    1        5.722  -0.089  -3.116  0.00  0.00    -0.274 OA
ATOM     11  C   LIG    1        3.487   0.226  -2.276  0.00  0.00    +0.204 C 
ATOM     12  N   LIG    1        2.656   0.097  -1.080  0.00  0.00    -0.287 N 
ATOM     13  C   LIG    1        1.278   0.092  -1.262  0.00  0.00    +0.250 C 
ATOM     14  O   LIG    1        0.749   0.236  -2.363  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1        3.335   0.416   0.170  0.00  0.00    +0.127 C 
ATOM     16  C   LIG    1        4.582  -0.451   0.309  0.00  0.00    +0.126 C 
BRANCH   8  18
ATOM     17  C   LIG    1        7.708   0.515  -0.294  0.00  0.00    +0.024 C 
ATOM     18  C   LIG    1        6.873  -0.700  -0.661  0.00  0.00    +0.104 C 
ENDBRANCH   8  18
ENDBRANCH   1  13
BRANCH   6  19
ATOM     19  C   LIG    1       -2.795   1.602   1.216  0.00  0.00    +0.162 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -4.096   0.941   1.332  0.00  0.00    -0.289 N 
ATOM     21  C   LIG    1       -4.757   0.400   0.186  0.00  0.00    +0.059 A 
ATOM     22  C   LIG    1       -5.992  -0.243   0.341  0.00  0.00    +0.063 A 
ATOM     23  C   LIG    1       -6.676  -0.796  -0.751  0.00  0.00    +0.015 A 
ATOM     24  C   LIG    1       -6.127  -0.710  -2.026  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1       -4.903  -0.073  -2.204  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1       -6.584  -0.340   1.683  0.00  0.00    +0.262 A 
ATOM     27  O   LIG    1       -7.653  -0.906   1.884  0.00  0.00    -0.267 OA
ATOM     28  N   LIG    1       -5.870   0.235   2.695  0.00  0.00    -0.274 N 
ATOM     29  H   LIG    1       -6.261   0.164   3.622  0.00  0.00    +0.173 HD
ATOM     30  C   LIG    1       -4.225   0.478  -1.110  0.00  0.00    +0.027 A 
ATOM     31  C   LIG    1       -4.653   0.845   2.599  0.00  0.00    +0.330 A 
ATOM     32  O   LIG    1       -4.112   1.263   3.621  0.00  0.00    -0.246 OA
ENDBRANCH  19  20
ENDBRANCH   6  19
TORSDOF 4