REMARK  Name = BDB019754
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.060  -1.231   0.713  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        1.104  -0.431   0.222  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1        2.233  -0.159   1.014  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1        2.297  -0.712   2.294  0.00  0.00    +0.128 A 
ATOM      5  F   LIG    1        3.358  -0.476   3.078  0.00  0.00    -0.205 F 
ATOM      6  C   LIG    1        1.273  -1.517   2.787  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1        0.153  -1.783   1.997  0.00  0.00    +0.016 A 
ENDROOT
BRANCH   1  10
ATOM      8  N   LIG    1       -2.310  -1.729   0.449  0.00  0.00    -0.307 N 
ATOM      9  H   LIG    1       -2.403  -1.503   1.429  0.00  0.00    +0.149 HD
ATOM     10  C   LIG    1       -1.105  -1.492  -0.176  0.00  0.00    +0.244 C 
ATOM     11  O   LIG    1       -0.962  -1.459  -1.393  0.00  0.00    -0.270 OA
BRANCH   8  12
ATOM     12  C   LIG    1       -3.537  -1.850  -0.307  0.00  0.00    +0.139 C 
BRANCH  12  19
ATOM     13  C   LIG    1       -7.132   1.121   1.612  0.00  0.00    +0.045 C 
ATOM     14  C   LIG    1       -6.023   0.912   0.620  0.00  0.00    -0.032 A 
ATOM     15  C   LIG    1       -5.654   1.907  -0.298  0.00  0.00    +0.044 A 
ATOM     16 CL   LIG    1       -6.454   3.438  -0.342  0.00  0.00    -0.083 Cl
ATOM     17  C   LIG    1       -4.617   1.686  -1.207  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1       -3.938   0.468  -1.213  0.00  0.00    +0.006 A 
ATOM     19  C   LIG    1       -4.292  -0.545  -0.313  0.00  0.00    -0.030 A 
ATOM     20  C   LIG    1       -5.329  -0.311   0.603  0.00  0.00    +0.010 A 
ENDBRANCH  12  19
ENDBRANCH   8  12
ENDBRANCH   1  10
BRANCH   3  21
ATOM     21  C   LIG    1        3.360   0.687   0.481  0.00  0.00    +0.142 C 
BRANCH  21  22
ATOM     22  N   LIG    1        4.166  -0.093  -0.439  0.00  0.00    -0.313 N 
ATOM     23  H   LIG    1        3.623  -0.661  -1.076  0.00  0.00    +0.149 HD
BRANCH  22  24
ATOM     24  C   LIG    1        5.235   0.475  -1.038  0.00  0.00    +0.176 C 
ATOM     25  N   LIG    1        5.792  -0.296  -2.008  0.00  0.00    -0.316 N 
ATOM     26  H   LIG    1        5.841  -1.277  -1.758  0.00  0.00    +0.149 HD
ATOM     27  C   LIG    1        7.066   0.309  -2.341  0.00  0.00    +0.127 C 
ATOM     28  C   LIG    1        6.905   1.711  -1.746  0.00  0.00    +0.163 C 
ATOM     29  N   LIG    1        5.779   1.624  -0.775  0.00  0.00    -0.255 NA
ENDBRANCH  22  24
ENDBRANCH  21  22
ENDBRANCH   3  21
TORSDOF 6