REMARK  Name = BDB031692
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.466   2.133  -0.358  0.00  0.00    -0.041 A 
ATOM      2  C   LIG    1       -0.768   2.320  -1.566  0.00  0.00    +0.031 A 
ATOM      3  C   LIG    1        0.567   1.904  -1.641  0.00  0.00    +0.068 A 
ATOM      4  C   LIG    1        1.247   1.325  -0.579  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1        2.564   1.058  -1.075  0.00  0.00    +0.154 A 
ATOM      6  N   LIG    1        2.674   1.433  -2.352  0.00  0.00    -0.157 NA
ATOM      7  C   LIG    1        0.561   1.151   0.638  0.00  0.00    +0.014 A 
ATOM      8  N   LIG    1        1.477   1.945  -2.659  0.00  0.00    -0.275 N 
ATOM      9  H   LIG    1        1.341   2.306  -3.596  0.00  0.00    +0.189 HD
ATOM     10  C   LIG    1       -0.778   1.563   0.728  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   1  15
ATOM     11  C   LIG    1       -3.208  -2.203  -0.089  0.00  0.00    +0.120 A 
ATOM     12  C   LIG    1       -3.095  -0.852  -0.452  0.00  0.00    +0.052 A 
ATOM     13  C   LIG    1       -3.882   0.095   0.187  0.00  0.00    -0.007 A 
ATOM     14  C   LIG    1       -4.027   1.584   0.049  0.00  0.00    +0.081 C 
ATOM     15  C   LIG    1       -2.905   2.569  -0.210  0.00  0.00    +0.040 C 
ATOM     16  C   LIG    1       -5.116   1.939   1.036  0.00  0.00    +0.228 C 
ATOM     17  N   LIG    1       -5.496   0.765   1.661  0.00  0.00    -0.284 N 
ATOM     18  H   LIG    1       -6.218   0.732   2.364  0.00  0.00    +0.155 HD
ATOM     19  O   LIG    1       -5.558   3.059   1.227  0.00  0.00    -0.274 OA
ATOM     20  C   LIG    1       -3.928   2.264  -1.287  0.00  0.00    +0.031 C 
ATOM     21  C   LIG    1       -4.785  -0.333   1.171  0.00  0.00    +0.038 A 
ATOM     22  C   LIG    1       -4.924  -1.650   1.554  0.00  0.00    +0.027 A 
ATOM     23  C   LIG    1       -4.117  -2.594   0.910  0.00  0.00    +0.047 A 
BRANCH  11  25
ATOM     24  C   LIG    1       -2.430  -4.424  -0.456  0.00  0.00    +0.277 C 
ATOM     25  O   LIG    1       -2.379  -3.042  -0.784  0.00  0.00    -0.495 OA
ENDBRANCH  11  25
ENDBRANCH   1  15
BRANCH   5  26
ATOM     26  N   LIG    1        3.508   0.479  -0.298  0.00  0.00    -0.280 N 
ATOM     27  H   LIG    1        3.288   0.272   0.668  0.00  0.00    +0.155 HD
BRANCH  26  28
ATOM     28  C   LIG    1        4.898   0.307  -0.518  0.00  0.00    +0.169 A 
ATOM     29  C   LIG    1        5.606  -0.460   0.416  0.00  0.00    +0.178 A 
ATOM     30  C   LIG    1        6.952  -0.634   0.154  0.00  0.00    +0.161 A 
ATOM     31  N   LIG    1        7.583  -0.122  -0.921  0.00  0.00    -0.240 NA
ATOM     32  C   LIG    1        6.811   0.591  -1.752  0.00  0.00    +0.223 A 
ATOM     33  N   LIG    1        5.504   0.831  -1.601  0.00  0.00    -0.217 NA
BRANCH  29  34
ATOM     34  O   LIG    1        4.913  -0.942   1.494  0.00  0.00    -0.490 OA
ATOM     35  C   LIG    1        5.632  -1.787   2.385  0.00  0.00    +0.277 C 
ENDBRANCH  29  34
ENDBRANCH  26  28
ENDBRANCH   5  26
TORSDOF 5