REMARK  Name = BDB035140
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.103  -1.256   0.554  0.00  0.00    -0.296 NA
ATOM      2  C   LIG    1        0.683  -0.345   1.379  0.00  0.00    +0.100 C 
ATOM      3  C   LIG    1        1.884   0.215   0.585  0.00  0.00    +0.100 C 
ATOM      4  N   LIG    1        1.466   1.034  -0.560  0.00  0.00    -0.292 NA
ATOM      5  C   LIG    1        0.215   0.581  -1.186  0.00  0.00    +0.100 C 
ATOM      6  C   LIG    1       -0.246  -0.860  -0.847  0.00  0.00    +0.100 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.532   1.398  -1.506  0.00  0.00    +0.101 C 
ATOM      8  C   LIG    1        3.721   2.161  -0.856  0.00  0.00    +0.166 C 
ATOM      9  N   LIG    1        4.799   1.304  -0.324  0.00  0.00    -0.267 NA
ATOM     10  C   LIG    1        5.013   0.204  -0.954  0.00  0.00    +0.120 C 
ATOM     11  C   LIG    1        4.247  -0.305  -2.110  0.00  0.00    +0.041 C 
ATOM     12  C   LIG    1        3.044   0.244  -2.326  0.00  0.00    -0.003 C 
BRANCH  10  13
ATOM     13  N   LIG    1        6.052  -0.539  -0.457  0.00  0.00    -0.270 N 
ATOM     14  H   LIG    1        6.500  -0.068   0.321  0.00  0.00    +0.156 HD
ATOM     15  C   LIG    1        6.575  -1.765  -0.831  0.00  0.00    +0.224 C 
ATOM     16  O   LIG    1        6.202  -2.459  -1.766  0.00  0.00    -0.275 OA
BRANCH  15  17
ATOM     17  C   LIG    1        7.692  -2.271   0.011  0.00  0.00    +0.112 C 
ATOM     18  C   LIG    1        8.480  -1.437   0.973  0.00  0.00    +0.179 C 
ATOM     19  F   LIG    1        8.135  -0.107   1.125  0.00  0.00    -0.245 F 
ATOM     20  C   LIG    1        9.106  -1.841  -0.321  0.00  0.00    +0.053 C 
ENDBRANCH  15  17
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  21
ATOM     21  C   LIG    1       -1.246  -1.897   1.183  0.00  0.00    +0.121 C 
BRANCH  21  31
ATOM     22  C   LIG    1       -5.868   0.727  -0.804  0.00  0.00    +0.077 C 
ATOM     23  C   LIG    1       -4.907   1.871  -0.517  0.00  0.00    +0.217 C 
ATOM     24  O   LIG    1       -4.727   2.787  -1.318  0.00  0.00    -0.275 OA
ATOM     25  N   LIG    1       -4.304   1.925   0.702  0.00  0.00    -0.307 N 
ATOM     26  H   LIG    1       -3.691   2.725   0.806  0.00  0.00    +0.149 HD
ATOM     27  C   LIG    1       -4.096   0.794   1.576  0.00  0.00    +0.121 C 
ATOM     28  C   LIG    1       -5.222  -0.250   1.489  0.00  0.00    +0.130 C 
ATOM     29  N   LIG    1       -4.863  -1.534   2.128  0.00  0.00    -0.286 NA
ATOM     30  C   LIG    1       -3.625  -1.881   2.053  0.00  0.00    +0.110 C 
ATOM     31  C   LIG    1       -2.502  -1.109   1.445  0.00  0.00    -0.018 C 
ATOM     32  C   LIG    1       -2.756   0.196   1.254  0.00  0.00    +0.003 C 
ATOM     33  C   LIG    1       -5.625  -0.529   0.036  0.00  0.00    +0.041 C 
BRANCH  22  35
ATOM     34  C   LIG    1       -7.899   1.598   0.560  0.00  0.00    +0.004 C 
ATOM     35  C   LIG    1       -7.322   1.232  -0.798  0.00  0.00    +0.009 C 
ENDBRANCH  22  35
ENDBRANCH  21  31
ENDBRANCH   1  21
TORSDOF 6