REMARK  Name = BDB020913
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.419  -2.416  -0.466  0.00  0.00    -0.003 A 
ATOM      2  C   LIG    1        1.091  -3.026  -0.239  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        1.022  -4.364  -0.088  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1        2.137  -5.181  -0.126  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        1.956  -6.613   0.062  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1        3.415  -4.678  -0.322  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1        4.443  -5.347  -0.356  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1        3.507  -3.210  -0.505  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  13
ATOM      9  N   LIG    1        3.000   1.732  -1.106  0.00  0.00    -0.192 N 
ATOM     10  C   LIG    1        3.288   1.254   0.156  0.00  0.00    +0.275 A 
ATOM     11  O   LIG    1        3.644   1.920   1.124  0.00  0.00    -0.265 OA
ATOM     12  C   LIG    1        3.132  -0.221   0.306  0.00  0.00    +0.081 A 
ATOM     13  C   LIG    1        2.627  -0.975  -0.692  0.00  0.00    -0.010 A 
ATOM     14  C   LIG    1        2.249  -0.324  -1.942  0.00  0.00    +0.029 A 
ATOM     15  C   LIG    1        2.433   0.992  -2.108  0.00  0.00    +0.121 A 
BRANCH   9  16
ATOM     16  O   LIG    1        2.941   3.129  -1.295  0.00  0.00    -0.265 OA
BRANCH  16  18
ATOM     17  C   LIG    1        4.156   5.106  -1.855  0.00  0.00    +0.037 C 
ATOM     18  C   LIG    1        4.253   3.617  -1.589  0.00  0.00    +0.190 C 
ENDBRANCH  16  18
ENDBRANCH   9  16
ENDBRANCH   1  13
BRANCH   2  19
ATOM     19  C   LIG    1       -0.102  -2.232  -0.190  0.00  0.00    +0.022 A 
ATOM     20  C   LIG    1       -0.332  -1.130   0.603  0.00  0.00    +0.123 A 
ATOM     21  N   LIG    1       -1.599  -0.660   0.303  0.00  0.00    -0.238 N 
ATOM     22  N   LIG    1       -2.197  -1.462  -0.605  0.00  0.00    -0.174 NA
ATOM     23  C   LIG    1       -1.297  -2.397  -0.904  0.00  0.00    +0.143 A 
BRANCH  21  24
ATOM     24  C   LIG    1       -2.240   0.513   0.811  0.00  0.00    +0.083 A 
ATOM     25  C   LIG    1       -3.612   0.793   0.584  0.00  0.00    +0.081 A 
ATOM     26  C   LIG    1       -4.199   1.985   1.103  0.00  0.00    -0.025 A 
ATOM     27  C   LIG    1       -3.372   2.878   1.810  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -2.028   2.606   2.034  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1       -1.465   1.432   1.544  0.00  0.00    +0.029 A 
BRANCH  26  30
ATOM     30  C   LIG    1       -5.664   2.338   0.888  0.00  0.00    +0.020 C 
ATOM     31  C   LIG    1       -6.501   2.910   2.013  0.00  0.00    +0.009 C 
ATOM     32  C   LIG    1       -6.743   1.509   1.550  0.00  0.00    +0.009 C 
ENDBRANCH  26  30
BRANCH  25  33
ATOM     33  C   LIG    1       -4.491  -0.092  -0.144  0.00  0.00    +0.102 C 
ATOM     34  N   LIG    1       -5.269  -0.750  -0.704  0.00  0.00    -0.191 NA
ENDBRANCH  25  33
ENDBRANCH  21  24
ENDBRANCH   2  19
TORSDOF 7