REMARK  Name = BDB035117
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.274   0.146   1.233  0.00  0.00    -0.299 NA
ATOM      2  C   LIG    1       -0.268   0.439   2.278  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1        0.972  -0.483   2.233  0.00  0.00    +0.120 C 
ATOM      4  N   LIG    1        1.675  -0.349   0.946  0.00  0.00    -0.326 N 
ATOM      5  C   LIG    1        0.866   0.106  -0.196  0.00  0.00    +0.120 C 
ATOM      6  C   LIG    1       -0.624  -0.284  -0.025  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.027  -0.612   0.824  0.00  0.00    +0.048 A 
ATOM      8  C   LIG    1        3.807  -0.151  -0.248  0.00  0.00    +0.134 A 
ATOM      9  N   LIG    1        5.135  -0.372  -0.432  0.00  0.00    -0.249 NA
ATOM     10  C   LIG    1        5.750  -1.113   0.526  0.00  0.00    +0.125 A 
ATOM     11  C   LIG    1        5.096  -1.627   1.633  0.00  0.00    +0.035 A 
ATOM     12  C   LIG    1        3.729  -1.369   1.771  0.00  0.00    +0.027 A 
BRANCH  10  13
ATOM     13  C   LIG    1        7.214  -1.364   0.335  0.00  0.00    +0.263 C 
ATOM     14  N   LIG    1        7.736  -0.797  -0.811  0.00  0.00    -0.307 N 
ATOM     15  H   LIG    1        7.061  -0.287  -1.377  0.00  0.00    +0.149 HD
ATOM     16  O   LIG    1        7.867  -2.017   1.140  0.00  0.00    -0.269 OA
BRANCH  14  17
ATOM     17  C   LIG    1        9.144  -0.919  -1.192  0.00  0.00    +0.073 C 
ATOM     18  C   LIG    1        9.529  -0.141  -2.474  0.00  0.00    +0.022 C 
ATOM     19  C   LIG    1       10.852   0.220  -1.767  0.00  0.00    +0.004 C 
ATOM     20  C   LIG    1       10.104   0.027  -0.432  0.00  0.00    +0.022 C 
ENDBRANCH  14  17
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  21
ATOM     21  C   LIG    1       -2.193   1.279   1.063  0.00  0.00    +0.093 C 
BRANCH  21  31
ATOM     22  C   LIG    1       -7.970   0.346  -0.981  0.00  0.00    +0.012 C 
ATOM     23  C   LIG    1       -6.928  -0.579  -1.528  0.00  0.00    +0.240 C 
ATOM     24  O   LIG    1       -7.085  -1.204  -2.571  0.00  0.00    -0.271 OA
ATOM     25  N   LIG    1       -5.771  -0.703  -0.808  0.00  0.00    -0.306 N 
ATOM     26  H   LIG    1       -5.182  -1.454  -1.145  0.00  0.00    +0.149 HD
ATOM     27  C   LIG    1       -5.694  -0.300   0.587  0.00  0.00    +0.102 C 
ATOM     28  C   LIG    1       -6.397   1.046   0.848  0.00  0.00    +0.148 C 
ATOM     29  N   LIG    1       -5.630   2.228   0.447  0.00  0.00    -0.286 NA
ATOM     30  C   LIG    1       -4.364   2.144   0.240  0.00  0.00    +0.083 C 
ATOM     31  C   LIG    1       -3.509   0.904   0.352  0.00  0.00    +0.046 C 
ATOM     32  C   LIG    1       -4.252  -0.223   1.068  0.00  0.00    +0.035 C 
ATOM     33  C   LIG    1       -7.697   1.105   0.098  0.00  0.00    +0.010 C 
BRANCH  22  35
ATOM     34  C   LIG    1      -10.180  -0.749  -1.458  0.00  0.00    +0.009 C 
ATOM     35  C   LIG    1       -9.267   0.437  -1.737  0.00  0.00    +0.037 C 
ENDBRANCH  22  35
ENDBRANCH  21  31
ENDBRANCH   1  21
TORSDOF 6