REMARK  Name = BDB034329
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.414   1.347   1.883  0.00  0.00    +0.034 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.796   1.615   2.486  0.00  0.00    +0.103 C 
BRANCH   2   3
ATOM      3  N   LIG    1       -2.852   0.819   1.865  0.00  0.00    -0.343 N 
ATOM      4  H   LIG    1       -2.773  -0.169   2.084  0.00  0.00    +0.146 HD
BRANCH   3  10
ATOM      5 BR   LIG    1       -6.932  -2.909  -2.417  0.00  0.00    -0.050 Br
ATOM      6  C   LIG    1       -5.825  -1.706  -1.468  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1       -5.437  -0.507  -2.060  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -4.629   0.400  -1.391  0.00  0.00    +0.074 A 
ATOM      9  C   LIG    1       -4.171   0.101  -0.083  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1       -3.318   1.049   0.560  0.00  0.00    +0.038 A 
ATOM     11  C   LIG    1       -3.071   2.253  -0.104  0.00  0.00    +0.043 A 
ATOM     12  C   LIG    1       -3.576   2.442  -1.377  0.00  0.00    +0.113 A 
ATOM     13  C   LIG    1       -4.593  -1.119   0.504  0.00  0.00    +0.013 A 
ATOM     14  N   LIG    1       -4.326   1.537  -2.029  0.00  0.00    -0.255 NA
ATOM     15  C   LIG    1       -5.411  -2.017  -0.183  0.00  0.00    +0.016 A 
ENDBRANCH   3  10
ENDBRANCH   2   3
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  C   LIG    1        0.081  -0.075   2.166  0.00  0.00    +0.083 C 
BRANCH  16  17
ATOM     17  N   LIG    1        1.443  -0.316   1.692  0.00  0.00    -0.312 NA
ATOM     18  H   LIG    1        2.049   0.472   1.918  0.00  0.00    +0.122 HD
BRANCH  17  19
ATOM     19  C   LIG    1        1.506  -0.566   0.252  0.00  0.00    +0.116 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.939  -0.754  -0.193  0.00  0.00    -0.033 A 
ATOM     21  C   LIG    1        3.574   0.228  -0.976  0.00  0.00    +0.015 A 
ATOM     22  C   LIG    1        4.911   0.045  -1.381  0.00  0.00    -0.000 A 
ATOM     23  C   LIG    1        5.579  -1.114  -0.989  0.00  0.00    +0.046 A 
ATOM     24  N   LIG    1        6.852  -1.044  -1.511  0.00  0.00    -0.361 N 
ATOM     25  H   LIG    1        7.561  -1.752  -1.385  0.00  0.00    +0.165 HD
ATOM     26  C   LIG    1        7.010   0.119  -2.218  0.00  0.00    +0.083 A 
ATOM     27  C   LIG    1        4.978  -2.104  -0.207  0.00  0.00    +0.026 A 
ATOM     28  C   LIG    1        5.824   0.814  -2.156  0.00  0.00    +0.027 A 
ATOM     29  C   LIG    1        3.649  -1.902   0.184  0.00  0.00    +0.007 A 
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 7