REMARK  Name = BDB019064
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.715  -0.005  -0.331  0.00  0.00    +0.027 A 
ATOM      2  C   LIG    1        1.189   1.030   0.485  0.00  0.00    +0.078 A 
ATOM      3  N   LIG    1       -0.171   1.246   0.425  0.00  0.00    -0.271 N 
ATOM      4  C   LIG    1       -0.446   2.257   1.310  0.00  0.00    +0.206 A 
ATOM      5  N   LIG    1        0.643   2.715   1.892  0.00  0.00    -0.243 NA
ATOM      6  C   LIG    1       -1.035   0.507  -0.409  0.00  0.00    +0.202 A 
ATOM      7  N   LIG    1       -0.538  -0.450  -1.148  0.00  0.00    -0.223 NA
ATOM      8  C   LIG    1        1.668   1.959   1.380  0.00  0.00    +0.139 A 
ATOM      9  C   LIG    1        0.822  -0.685  -1.084  0.00  0.00    +0.125 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        5.799  -1.123  -0.531  0.00  0.00    +0.043 A 
ATOM     11  N   LIG    1        5.181  -0.690  -1.656  0.00  0.00    -0.259 NA
ATOM     12  C   LIG    1        3.875  -0.340  -1.554  0.00  0.00    +0.119 A 
ATOM     13  C   LIG    1        3.133  -0.405  -0.379  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        3.796  -0.850   0.766  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1        5.139  -1.214   0.692  0.00  0.00    +0.024 A 
BRANCH  10  16
ATOM     16  C   LIG    1        7.253  -1.504  -0.660  0.00  0.00    +0.083 C 
BRANCH  16  17
ATOM     17  C   LIG    1        8.179  -0.503   0.026  0.00  0.00    +0.162 C 
BRANCH  17  18
ATOM     18  O   LIG    1        8.260  -0.757   1.428  0.00  0.00    -0.395 OA
ATOM     19  H   LIG    1        8.768  -1.579   1.546  0.00  0.00    +0.209 HD
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH  10  16
ENDBRANCH   1  13
BRANCH   6  20
ATOM     20  N   LIG    1       -2.380   0.814  -0.418  0.00  0.00    -0.310 N 
ATOM     21  H   LIG    1       -2.634   1.764  -0.170  0.00  0.00    +0.149 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -3.265   0.244  -1.418  0.00  0.00    +0.143 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -4.689   0.525  -1.037  0.00  0.00    +0.012 A 
ATOM     24  C   LIG    1       -5.340  -0.177  -0.026  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1       -4.870  -1.317   0.799  0.00  0.00    +0.080 C 
ATOM     26  C   LIG    1       -5.982  -1.337   1.848  0.00  0.00    +0.234 C 
ATOM     27  O   LIG    1       -7.157  -0.693   1.304  0.00  0.00    -0.491 OA
ATOM     28  C   LIG    1       -6.660   0.100   0.304  0.00  0.00    +0.124 A 
ATOM     29  C   LIG    1       -7.391   1.077  -0.342  0.00  0.00    +0.049 A 
ATOM     30  C   LIG    1       -6.755   1.807  -1.345  0.00  0.00    +0.042 A 
ATOM     31  C   LIG    1       -5.422   1.531  -1.679  0.00  0.00    +0.129 A 
ATOM     32  F   LIG    1       -4.841   2.260  -2.643  0.00  0.00    -0.205 F 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   6  20
TORSDOF 7