REMARK  Name = BDB013709
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.158  -0.015  -0.100  0.00  0.00    -0.322 N 
ATOM      2  H   LIG    1        0.064   0.183   0.896  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.406   0.118  -0.671  0.00  0.00    +0.147 A 
ATOM      4  C   LIG    1        2.611  -0.076   0.177  0.00  0.00    +0.029 A 
ATOM      5  C   LIG    1        3.854   0.158  -0.396  0.00  0.00    +0.051 A 
ATOM      6  C   LIG    1        5.024   0.010   0.363  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        4.945  -0.386   1.697  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1        3.701  -0.642   2.271  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        3.937   0.541  -1.815  0.00  0.00    +0.275 A 
ATOM     10  O   LIG    1        5.035   0.789  -2.309  0.00  0.00    -0.266 OA
ATOM     11  N   LIG    1        2.736   0.584  -2.512  0.00  0.00    -0.230 N 
ATOM     12  C   LIG    1        2.728   0.959  -3.912  0.00  0.00    +0.176 C 
ATOM     13  C   LIG    1        2.535  -0.492   1.515  0.00  0.00    +0.012 A 
ATOM     14  N   LIG    1        1.505   0.415  -1.937  0.00  0.00    -0.153 NA
ENDBRANCH   1   3
BRANCH   1  16
ATOM     15  C   LIG    1       -2.230   0.678   0.263  0.00  0.00    +0.107 C 
ATOM     16  C   LIG    1       -1.085   0.375  -0.798  0.00  0.00    +0.098 C 
ATOM     17  C   LIG    1       -1.579  -0.785  -1.669  0.00  0.00    +0.059 C 
ATOM     18  C   LIG    1       -2.495  -1.506  -0.729  0.00  0.00    -0.041 A 
ATOM     19  C   LIG    1       -3.000  -2.787  -0.912  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1       -3.934  -3.270  -0.001  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -4.374  -2.458   1.050  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -3.866  -1.164   1.215  0.00  0.00    +0.005 A 
ATOM     23  C   LIG    1       -2.883  -0.696   0.351  0.00  0.00    -0.025 A 
BRANCH  15  25
ATOM     24  C   LIG    1       -1.165   2.652   1.194  0.00  0.00    +0.105 C 
ATOM     25  N   LIG    1       -1.633   1.286   1.496  0.00  0.00    -0.300 NA
ATOM     26  C   LIG    1       -2.556   1.369   2.627  0.00  0.00    +0.105 C 
ENDBRANCH  15  25
ENDBRANCH   1  16
TORSDOF 3