REMARK  Name = BDB019740
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.027   0.659  -0.467  0.00  0.00    +0.040 A 
ATOM      2  C   LIG    1        1.054   1.155   0.279  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1        2.140   1.787  -0.352  0.00  0.00    +0.008 A 
ATOM      4  C   LIG    1        2.088   1.958  -1.738  0.00  0.00    +0.163 A 
ATOM      5  F   LIG    1        3.080   2.603  -2.369  0.00  0.00    -0.202 F 
ATOM      6  C   LIG    1        1.005   1.486  -2.475  0.00  0.00    +0.159 A 
ATOM      7  F   LIG    1        0.966   1.670  -3.802  0.00  0.00    -0.202 F 
ATOM      8  C   LIG    1       -0.056   0.836  -1.853  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   1  10
ATOM      9  O   LIG    1       -1.427   0.340   1.394  0.00  0.00    -0.270 OA
ATOM     10  C   LIG    1       -1.137  -0.013   0.257  0.00  0.00    +0.244 C 
ATOM     11  N   LIG    1       -1.776  -1.030  -0.416  0.00  0.00    -0.307 N 
ATOM     12  H   LIG    1       -1.461  -1.316  -1.332  0.00  0.00    +0.149 HD
BRANCH  11  13
ATOM     13  C   LIG    1       -2.909  -1.723   0.151  0.00  0.00    +0.140 C 
BRANCH  13  14
ATOM     14  C   LIG    1       -4.196  -1.192  -0.428  0.00  0.00    -0.029 A 
ATOM     15  C   LIG    1       -4.825  -1.843  -1.499  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1       -6.007  -1.330  -2.048  0.00  0.00    +0.060 A 
ATOM     17 CL   LIG    1       -6.719  -2.196  -3.364  0.00  0.00    -0.082 Cl
ATOM     18  C   LIG    1       -6.566  -0.157  -1.532  0.00  0.00    +0.059 A 
ATOM     19 CL   LIG    1       -8.021   0.532  -2.160  0.00  0.00    -0.082 Cl
ATOM     20  C   LIG    1       -5.940   0.501  -0.470  0.00  0.00    +0.022 A 
ATOM     21  C   LIG    1       -4.761  -0.011   0.076  0.00  0.00    +0.007 A 
ENDBRANCH  13  14
ENDBRANCH  11  13
ENDBRANCH   1  10
BRANCH   3  22
ATOM     22  C   LIG    1        3.319   2.333   0.413  0.00  0.00    +0.142 C 
BRANCH  22  23
ATOM     23  N   LIG    1        3.589   1.593   1.636  0.00  0.00    -0.313 N 
ATOM     24  H   LIG    1        3.976   2.180   2.365  0.00  0.00    +0.149 HD
BRANCH  23  25
ATOM     25  C   LIG    1        4.195   0.384   1.594  0.00  0.00    +0.176 C 
ATOM     26  N   LIG    1        4.562  -0.080   2.818  0.00  0.00    -0.316 N 
ATOM     27  H   LIG    1        3.866   0.088   3.535  0.00  0.00    +0.149 HD
ATOM     28  C   LIG    1        4.926  -1.472   2.645  0.00  0.00    +0.127 C 
ATOM     29  C   LIG    1        5.112  -1.555   1.127  0.00  0.00    +0.163 C 
ATOM     30  N   LIG    1        4.425  -0.364   0.559  0.00  0.00    -0.255 NA
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH   3  22
TORSDOF 6