REMARK  Name = BDB042434
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.421   0.353   1.859  0.00  0.00    +0.085 C 
ENDROOT
BRANCH   1   5
ATOM      2  N   LIG    1       -2.824  -0.169  -0.713  0.00  0.00    -0.327 N 
ATOM      3  C   LIG    1       -2.047   1.047  -0.392  0.00  0.00    +0.120 C 
ATOM      4  C   LIG    1       -1.763   1.154   1.123  0.00  0.00    +0.103 C 
ATOM      5  N   LIG    1       -1.002   0.015   1.694  0.00  0.00    -0.299 NA
ATOM      6  C   LIG    1       -1.193  -1.209   0.876  0.00  0.00    +0.103 C 
ATOM      7  C   LIG    1       -2.585  -1.309   0.209  0.00  0.00    +0.120 C 
BRANCH   2  11
ATOM      8  C   LIG    1       -6.879   0.059  -1.906  0.00  0.00    +0.052 A 
ATOM      9  C   LIG    1       -6.080  -1.020  -2.281  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -4.742  -1.072  -1.874  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1       -4.167  -0.057  -1.091  0.00  0.00    +0.030 A 
ATOM     12  C   LIG    1       -4.990   1.016  -0.724  0.00  0.00    +0.024 A 
ATOM     13  C   LIG    1       -6.332   1.077  -1.125  0.00  0.00    +0.020 A 
BRANCH   8  15
ATOM     14  N   LIG    1       -9.362   0.170  -2.650  0.00  0.00    -0.191 NA
ATOM     15  C   LIG    1       -8.251   0.120  -2.318  0.00  0.00    +0.099 C 
ENDBRANCH   8  15
ENDBRANCH   2  11
ENDBRANCH   1   5
BRANCH   1  16
ATOM     16  C   LIG    1        1.204  -0.729   2.619  0.00  0.00    +0.021 C 
BRANCH  16  17
ATOM     17  C   LIG    1        2.652  -0.308   2.916  0.00  0.00    +0.054 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.585  -0.120   1.738  0.00  0.00    +0.020 A 
ATOM     19  N   LIG    1        4.654   0.722   1.958  0.00  0.00    -0.326 N 
ATOM     20  H   LIG    1        4.778   1.159   2.865  0.00  0.00    +0.169 HD
ATOM     21  C   LIG    1        5.627   1.046   1.035  0.00  0.00    +0.259 A 
ATOM     22  O   LIG    1        6.538   1.808   1.333  0.00  0.00    -0.267 OA
ATOM     23  C   LIG    1        5.492   0.426  -0.302  0.00  0.00    +0.082 A 
ATOM     24  C   LIG    1        4.408  -0.434  -0.535  0.00  0.00    -0.008 A 
ATOM     25  C   LIG    1        4.260  -1.032  -1.794  0.00  0.00    +0.009 A 
ATOM     26  C   LIG    1        5.185  -0.773  -2.809  0.00  0.00    +0.003 A 
ATOM     27  C   LIG    1        6.259   0.083  -2.570  0.00  0.00    +0.039 A 
ATOM     28  C   LIG    1        6.410   0.679  -1.320  0.00  0.00    +0.136 A 
ATOM     29  F   LIG    1        7.457   1.494  -1.136  0.00  0.00    -0.205 F 
ATOM     30  C   LIG    1        3.441  -0.700   0.534  0.00  0.00    +0.030 A 
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 6