REMARK  Name = BDB061202
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.738   0.477   0.232  0.00  0.00    +0.031 A 
ATOM      2  C   LIG    1       -1.605  -0.862  -0.156  0.00  0.00    +0.063 A 
ATOM      3  C   LIG    1       -0.481  -1.252  -0.892  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -0.323  -2.668  -1.222  0.00  0.00    +0.144 A 
ATOM      5  N   LIG    1       -1.180  -3.590  -0.913  0.00  0.00    -0.179 NA
ATOM      6  N   LIG    1       -2.287  -3.200  -0.234  0.00  0.00    -0.243 N 
ATOM      7  H   LIG    1       -2.957  -3.928  -0.002  0.00  0.00    +0.192 HD
ATOM      8  C   LIG    1        0.486  -0.317  -1.266  0.00  0.00    +0.128 A 
ATOM      9  N   LIG    1        0.355   0.972  -0.908  0.00  0.00    -0.239 NA
ATOM     10  C   LIG    1       -2.593  -1.919   0.170  0.00  0.00    +0.273 A 
ATOM     11  O   LIG    1       -3.654  -1.693   0.738  0.00  0.00    -0.266 OA
ATOM     12  C   LIG    1       -0.719   1.336  -0.169  0.00  0.00    +0.123 A 
ENDROOT
BRANCH   1  17
ATOM     13  C   LIG    1       -6.232   2.152   1.718  0.00  0.00    +0.086 C 
ATOM     14  C   LIG    1       -4.784   1.822   1.732  0.00  0.00    +0.107 A 
ATOM     15  N   LIG    1       -4.122   1.234   0.675  0.00  0.00    -0.331 N 
ATOM     16  C   LIG    1       -4.731   0.904  -0.593  0.00  0.00    +0.150 C 
ATOM     17  C   LIG    1       -2.809   1.036   1.050  0.00  0.00    +0.071 A 
ATOM     18  C   LIG    1       -2.749   1.555   2.331  0.00  0.00    +0.139 A 
ATOM     19  N   LIG    1       -3.959   2.046   2.733  0.00  0.00    -0.240 NA
ENDBRANCH   1  17
BRANCH   8  20
ATOM     20  N   LIG    1        1.607  -0.703  -2.023  0.00  0.00    -0.324 N 
ATOM     21  H   LIG    1        1.287  -1.052  -2.923  0.00  0.00    +0.148 HD
BRANCH  20  22
ATOM     22  C   LIG    1        2.641   0.319  -2.217  0.00  0.00    +0.141 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.483   0.538  -0.989  0.00  0.00    +0.012 A 
ATOM     24  C   LIG    1        4.052  -0.498  -0.251  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1        3.928  -1.968  -0.403  0.00  0.00    +0.080 C 
ATOM     26  C   LIG    1        5.049  -2.411   0.535  0.00  0.00    +0.234 C 
ATOM     27  O   LIG    1        5.304  -1.361   1.494  0.00  0.00    -0.491 OA
ATOM     28  C   LIG    1        4.830  -0.235   0.872  0.00  0.00    +0.124 A 
ATOM     29  C   LIG    1        5.082   1.048   1.312  0.00  0.00    +0.049 A 
ATOM     30  C   LIG    1        4.545   2.102   0.576  0.00  0.00    +0.042 A 
ATOM     31  C   LIG    1        3.765   1.843  -0.560  0.00  0.00    +0.129 A 
ATOM     32  F   LIG    1        3.290   2.889  -1.252  0.00  0.00    -0.205 F 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   8  20
TORSDOF 4