REMARK  Name = BDB019570
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.450  -0.737  -0.295  0.00  0.00    +0.126 A 
ATOM      2  N   LIG    1       -1.356  -1.642   0.145  0.00  0.00    -0.242 NA
ATOM      3  C   LIG    1       -2.643  -1.244   0.255  0.00  0.00    +0.074 A 
ATOM      4  C   LIG    1       -3.051   0.045  -0.097  0.00  0.00    +0.033 A 
ATOM      5  C   LIG    1       -2.107   0.979  -0.543  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1       -0.777   0.565  -0.657  0.00  0.00    +0.038 A 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -3.579  -2.281   0.720  0.00  0.00    +0.019 A 
ATOM      8  C   LIG    1       -4.462  -2.116   1.808  0.00  0.00    +0.053 A 
ATOM      9 CL   LIG    1       -4.501  -0.669   2.761  0.00  0.00    -0.083 Cl
ATOM     10  C   LIG    1       -5.334  -3.142   2.192  0.00  0.00    +0.059 A 
ATOM     11  C   LIG    1       -5.325  -4.345   1.502  0.00  0.00    +0.125 A 
ATOM     12  F   LIG    1       -6.160  -5.324   1.873  0.00  0.00    -0.205 F 
ATOM     13  C   LIG    1       -4.458  -4.551   0.440  0.00  0.00    +0.039 A 
ATOM     14  C   LIG    1       -3.590  -3.528   0.056  0.00  0.00    +0.014 A 
ENDBRANCH   3   7
BRANCH   1  17
ATOM     15  N   LIG    1        1.922  -0.319   0.070  0.00  0.00    -0.307 N 
ATOM     16  H   LIG    1        1.631   0.520   0.555  0.00  0.00    +0.149 HD
ATOM     17  C   LIG    1        0.967  -1.208  -0.391  0.00  0.00    +0.263 C 
ATOM     18  O   LIG    1        1.235  -2.312  -0.853  0.00  0.00    -0.269 OA
BRANCH  15  19
ATOM     19  C   LIG    1        3.342  -0.642   0.060  0.00  0.00    +0.076 C 
BRANCH  19  20
ATOM     20  C   LIG    1        3.992   0.152   1.172  0.00  0.00    +0.009 C 
ATOM     21  C   LIG    1        5.242   0.996   1.040  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1        3.909   1.664   1.211  0.00  0.00    +0.005 C 
ENDBRANCH  19  20
BRANCH  19  24
ATOM     23  C   LIG    1        5.208  -1.240  -1.565  0.00  0.00    +0.006 C 
ATOM     24  C   LIG    1        3.931  -0.438  -1.345  0.00  0.00    +0.019 C 
ENDBRANCH  19  24
ENDBRANCH  15  19
ENDBRANCH   1  17
BRANCH   5  25
ATOM     25  C   LIG    1       -2.539   2.373  -0.929  0.00  0.00    +0.158 C 
BRANCH  25  26
ATOM     26  N   LIG    1       -1.691   3.393  -0.336  0.00  0.00    -0.332 N 
ATOM     27  C   LIG    1       -1.619   3.701   0.994  0.00  0.00    +0.199 A 
ATOM     28  N   LIG    1       -0.746   4.658   1.214  0.00  0.00    -0.244 NA
ATOM     29  C   LIG    1       -0.255   4.996  -0.020  0.00  0.00    +0.130 A 
ATOM     30  C   LIG    1       -0.832   4.223  -1.002  0.00  0.00    +0.107 A 
ENDBRANCH  25  26
ENDBRANCH   5  25
TORSDOF 7