REMARK  Name = BDB013715
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.350   0.006   0.042  0.00  0.00    +0.147 A 
ATOM      2  C   LIG    1        2.394  -0.552  -0.862  0.00  0.00    +0.029 A 
ATOM      3  C   LIG    1        3.723  -0.426  -0.476  0.00  0.00    +0.051 A 
ATOM      4  C   LIG    1        4.748  -0.953  -1.276  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1        4.438  -1.595  -2.474  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        3.109  -1.703  -2.878  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        4.053   0.290   0.766  0.00  0.00    +0.275 A 
ATOM      8  O   LIG    1        5.227   0.363   1.126  0.00  0.00    -0.266 OA
ATOM      9  N   LIG    1        2.987   0.858   1.448  0.00  0.00    -0.230 N 
ATOM     10  C   LIG    1        3.220   1.573   2.688  0.00  0.00    +0.176 C 
ATOM     11  C   LIG    1        2.087  -1.180  -2.078  0.00  0.00    +0.012 A 
ATOM     12  N   LIG    1        1.673   0.678   1.111  0.00  0.00    -0.153 NA
ENDROOT
BRANCH   1  13
ATOM     13  N   LIG    1        0.016  -0.204  -0.262  0.00  0.00    -0.323 N 
ATOM     14  H   LIG    1       -0.199  -1.018  -0.822  0.00  0.00    +0.148 HD
BRANCH  13  16
ATOM     15  C   LIG    1       -2.390   0.434  -0.194  0.00  0.00    +0.076 C 
ATOM     16  C   LIG    1       -1.078   0.175   0.649  0.00  0.00    +0.089 C 
ATOM     17  C   LIG    1       -1.257  -0.902   1.727  0.00  0.00    +0.024 C 
ATOM     18  C   LIG    1       -1.771  -2.230   1.178  0.00  0.00    +0.002 C 
ATOM     19  C   LIG    1       -2.807  -2.063   0.072  0.00  0.00    +0.002 C 
ATOM     20  C   LIG    1       -3.439  -0.675   0.075  0.00  0.00    +0.021 C 
BRANCH  15  22
ATOM     21  C   LIG    1       -4.259   2.006  -0.594  0.00  0.00    +0.104 C 
ATOM     22  N   LIG    1       -2.940   1.808   0.017  0.00  0.00    -0.304 NA
ATOM     23  C   LIG    1       -2.024   2.826  -0.525  0.00  0.00    +0.104 C 
ENDBRANCH  15  22
ENDBRANCH  13  16
ENDBRANCH   1  13
TORSDOF 3