REMARK  Name = BDB019083
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.041  -0.280  -0.355  0.00  0.00    +0.027 A 
ATOM      2  C   LIG    1        0.312  -0.429  -1.561  0.00  0.00    +0.078 A 
ATOM      3  N   LIG    1       -0.968   0.078  -1.584  0.00  0.00    -0.271 N 
ATOM      4  C   LIG    1       -1.479  -0.209  -2.824  0.00  0.00    +0.206 A 
ATOM      5  N   LIG    1       -0.604  -0.830  -3.587  0.00  0.00    -0.243 NA
ATOM      6  C   LIG    1       -1.558   0.739  -0.486  0.00  0.00    +0.202 A 
ATOM      7  N   LIG    1       -0.874   0.862   0.622  0.00  0.00    -0.223 NA
ATOM      8  C   LIG    1        0.516  -0.974  -2.807  0.00  0.00    +0.139 A 
ATOM      9  C   LIG    1        0.407   0.348   0.659  0.00  0.00    +0.125 A 
ENDROOT
BRANCH   1  12
ATOM     10  C   LIG    1        1.632  -3.095   0.506  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1        2.708  -2.072   0.274  0.00  0.00    -0.039 A 
ATOM     12  C   LIG    1        2.415  -0.761  -0.136  0.00  0.00    +0.007 A 
ATOM     13  C   LIG    1        3.485   0.109  -0.348  0.00  0.00    +0.120 A 
ATOM     14  N   LIG    1        4.788  -0.217  -0.180  0.00  0.00    -0.250 NA
ATOM     15  C   LIG    1        5.052  -1.486   0.223  0.00  0.00    +0.126 A 
ATOM     16  C   LIG    1        4.053  -2.432   0.444  0.00  0.00    +0.037 A 
BRANCH  15  17
ATOM     17  C   LIG    1        6.487  -1.909   0.368  0.00  0.00    +0.264 C 
ATOM     18  N   LIG    1        7.483  -0.974   0.675  0.00  0.00    -0.302 N 
ATOM     19  C   LIG    1        8.876  -1.369   0.558  0.00  0.00    +0.132 C 
ATOM     20  C   LIG    1        7.235   0.408   1.054  0.00  0.00    +0.132 C 
ATOM     21  O   LIG    1        6.745  -3.105   0.209  0.00  0.00    -0.268 OA
ENDBRANCH  15  17
ENDBRANCH   1  12
BRANCH   6  22
ATOM     22  N   LIG    1       -2.840   1.231  -0.612  0.00  0.00    -0.310 N 
ATOM     23  H   LIG    1       -3.157   1.459  -1.548  0.00  0.00    +0.149 HD
BRANCH  22  24
ATOM     24  C   LIG    1       -3.403   2.109   0.400  0.00  0.00    +0.143 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -4.871   2.287   0.143  0.00  0.00    +0.012 A 
ATOM     26  C   LIG    1       -5.792   1.266   0.356  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -5.580  -0.135   0.795  0.00  0.00    +0.080 C 
ATOM     28  C   LIG    1       -7.030  -0.526   1.081  0.00  0.00    +0.234 C 
ATOM     29  O   LIG    1       -7.910   0.340   0.327  0.00  0.00    -0.491 OA
ATOM     30  C   LIG    1       -7.142   1.448   0.082  0.00  0.00    +0.124 A 
ATOM     31  C   LIG    1       -7.639   2.636  -0.413  0.00  0.00    +0.049 A 
ATOM     32  C   LIG    1       -6.737   3.678  -0.628  0.00  0.00    +0.042 A 
ATOM     33  C   LIG    1       -5.374   3.498  -0.351  0.00  0.00    +0.129 A 
ATOM     34  F   LIG    1       -4.535   4.516  -0.588  0.00  0.00    -0.205 F 
ENDBRANCH  24  25
ENDBRANCH  22  24
ENDBRANCH   6  22
TORSDOF 5