REMARK  Name = BDB013670
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.141  -0.651   0.265  0.00  0.00    +0.166 A 
ATOM      2  C   LIG    1        2.314   0.128  -0.223  0.00  0.00    +0.117 A 
ATOM      3  C   LIG    1        3.043   0.863   0.680  0.00  0.00    +0.070 A 
ATOM      4  C   LIG    1        4.128   1.599   0.203  0.00  0.00    +0.017 A 
ATOM      5  C   LIG    1        4.428   1.563  -1.159  0.00  0.00    +0.020 A 
ATOM      6  C   LIG    1        3.630   0.791  -1.993  0.00  0.00    +0.111 A 
ATOM      7  C   LIG    1        2.658   0.851   2.091  0.00  0.00    +0.276 A 
ATOM      8  O   LIG    1        3.300   1.533   2.886  0.00  0.00    -0.266 OA
ATOM      9  N   LIG    1        1.573   0.050   2.429  0.00  0.00    -0.230 N 
ATOM     10  C   LIG    1        1.108  -0.000   3.803  0.00  0.00    +0.176 C 
ATOM     11  N   LIG    1        2.574   0.067  -1.563  0.00  0.00    -0.251 NA
ATOM     12  N   LIG    1        0.822  -0.663   1.527  0.00  0.00    -0.151 NA
ENDROOT
BRANCH   1  13
ATOM     13  N   LIG    1        0.429  -1.353  -0.698  0.00  0.00    -0.322 N 
ATOM     14  H   LIG    1        0.719  -1.032  -1.627  0.00  0.00    +0.148 HD
BRANCH  13  16
ATOM     15  C   LIG    1       -1.843  -0.264  -0.889  0.00  0.00    +0.076 C 
ATOM     16  C   LIG    1       -1.021  -1.585  -0.678  0.00  0.00    +0.089 C 
ATOM     17  C   LIG    1       -1.476  -2.453   0.505  0.00  0.00    +0.024 C 
ATOM     18  C   LIG    1       -2.717  -1.908   1.197  0.00  0.00    +0.002 C 
ATOM     19  C   LIG    1       -2.535  -0.453   1.602  0.00  0.00    +0.002 C 
ATOM     20  C   LIG    1       -2.072   0.458   0.460  0.00  0.00    +0.021 C 
BRANCH  15  22
ATOM     21  C   LIG    1       -1.861   1.948  -2.003  0.00  0.00    +0.104 C 
ATOM     22  N   LIG    1       -1.260   0.613  -1.958  0.00  0.00    -0.304 NA
ATOM     23  C   LIG    1       -1.379  -0.003  -3.286  0.00  0.00    +0.104 C 
ENDBRANCH  15  22
ENDBRANCH  13  16
ENDBRANCH   1  13
TORSDOF 3