REMARK  Name = BDB042435
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.094  -1.556  -0.971  0.00  0.00    +0.085 C 
ENDROOT
BRANCH   1   5
ATOM      2  N   LIG    1       -3.463   0.809  -0.965  0.00  0.00    -0.327 N 
ATOM      3  C   LIG    1       -3.137  -0.315  -1.859  0.00  0.00    +0.120 C 
ATOM      4  C   LIG    1       -1.660  -0.257  -2.318  0.00  0.00    +0.103 C 
ATOM      5  N   LIG    1       -0.648  -0.221  -1.237  0.00  0.00    -0.299 NA
ATOM      6  C   LIG    1       -1.208   0.400  -0.013  0.00  0.00    +0.103 C 
ATOM      7  C   LIG    1       -2.327   1.438  -0.271  0.00  0.00    +0.120 C 
BRANCH   2  11
ATOM      8  C   LIG    1       -7.386   2.384  -0.748  0.00  0.00    +0.052 A 
ATOM      9  C   LIG    1       -7.171   1.078  -1.184  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -5.869   0.565  -1.254  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1       -4.744   1.328  -0.896  0.00  0.00    +0.030 A 
ATOM     12  C   LIG    1       -4.995   2.639  -0.456  0.00  0.00    +0.024 A 
ATOM     13  C   LIG    1       -6.292   3.165  -0.383  0.00  0.00    +0.020 A 
BRANCH   8  15
ATOM     14  N   LIG    1       -9.791   3.345  -0.616  0.00  0.00    -0.191 NA
ATOM     15  C   LIG    1       -8.715   2.915  -0.675  0.00  0.00    +0.099 C 
ENDBRANCH   8  15
ENDBRANCH   2  11
ENDBRANCH   1   5
BRANCH   1  16
ATOM     16  C   LIG    1        1.102  -1.555  -0.007  0.00  0.00    +0.021 C 
BRANCH  16  17
ATOM     17  C   LIG    1        2.277  -0.719  -0.527  0.00  0.00    +0.054 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.465  -0.783   0.401  0.00  0.00    +0.020 A 
ATOM     19  N   LIG    1        3.369  -0.086   1.585  0.00  0.00    -0.326 N 
ATOM     20  H   LIG    1        2.527   0.436   1.796  0.00  0.00    +0.169 HD
ATOM     21  C   LIG    1        4.352  -0.020   2.547  0.00  0.00    +0.257 A 
ATOM     22  O   LIG    1        4.202   0.617   3.583  0.00  0.00    -0.267 OA
ATOM     23  C   LIG    1        5.602  -0.764   2.260  0.00  0.00    +0.049 A 
ATOM     24  C   LIG    1        5.706  -1.470   1.050  0.00  0.00    -0.011 A 
ATOM     25  C   LIG    1        6.883  -2.174   0.768  0.00  0.00    +0.011 A 
ATOM     26  C   LIG    1        7.935  -2.168   1.688  0.00  0.00    +0.039 A 
ATOM     27  C   LIG    1        7.809  -1.461   2.881  0.00  0.00    +0.124 A 
ATOM     28  F   LIG    1        8.825  -1.463   3.754  0.00  0.00    -0.205 F 
ATOM     29  C   LIG    1        6.652  -0.756   3.181  0.00  0.00    +0.052 A 
ATOM     30  C   LIG    1        4.587  -1.459   0.105  0.00  0.00    +0.030 A 
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 6