REMARK  Name = BDB007604
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.805   0.041  -0.083  0.00  0.00    +0.244 C 
ATOM      2  N   LIG    1        1.229   0.637  -1.253  0.00  0.00    -0.309 N 
ATOM      3  H   LIG    1        0.652   0.532  -2.077  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1        1.562  -0.257   0.835  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   8
ATOM      5  C   LIG    1       -3.391  -0.968   0.218  0.00  0.00    +0.027 A 
ATOM      6  C   LIG    1       -2.412  -1.623   0.981  0.00  0.00    +0.023 A 
ATOM      7  C   LIG    1       -1.056  -1.295   0.874  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1       -0.647  -0.283   0.004  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1       -1.611   0.415  -0.727  0.00  0.00    +0.015 A 
ATOM     10  C   LIG    1       -2.968   0.078  -0.610  0.00  0.00    +0.023 A 
BRANCH   5  11
ATOM     11  N   LIG    1       -4.727  -1.311   0.432  0.00  0.00    -0.341 N 
ATOM     12  H   LIG    1       -4.813  -2.288   0.706  0.00  0.00    +0.146 HD
BRANCH  11  18
ATOM     13  C   LIG    1       -9.967   1.165   1.256  0.00  0.00    +0.109 C 
ATOM     14  C   LIG    1       -9.548  -0.253   0.963  0.00  0.00    +0.212 C 
ATOM     15  N   LIG    1       -8.212  -0.573   1.159  0.00  0.00    -0.302 N 
ATOM     16  C   LIG    1       -7.747  -1.912   0.823  0.00  0.00    +0.109 C 
ATOM     17  C   LIG    1       -6.947  -1.878  -0.478  0.00  0.00    +0.041 C 
ATOM     18  C   LIG    1       -5.811  -0.836  -0.439  0.00  0.00    +0.073 C 
ATOM     19  C   LIG    1       -6.333   0.527   0.051  0.00  0.00    +0.041 C 
ATOM     20  C   LIG    1       -7.137   0.399   1.343  0.00  0.00    +0.109 C 
ATOM     21  O   LIG    1      -10.378  -1.073   0.570  0.00  0.00    -0.276 OA
ENDBRANCH  11  18
ENDBRANCH   5  11
ENDBRANCH   1   8
BRANCH   2  22
ATOM     22  C   LIG    1        2.648   0.846  -1.509  0.00  0.00    +0.137 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.341  -0.456  -1.941  0.00  0.00    +0.145 C 
BRANCH  23  24
ATOM     24  O   LIG    1        2.717  -0.919  -3.156  0.00  0.00    -0.389 OA
ATOM     25  H   LIG    1        3.042  -1.823  -3.309  0.00  0.00    +0.210 HD
ENDBRANCH  23  24
BRANCH  23  26
ATOM     26  C   LIG    1        4.851  -0.257  -2.203  0.00  0.00    +0.117 C 
BRANCH  26  27
ATOM     27  N   LIG    1        5.627   0.330  -1.100  0.00  0.00    -0.295 NA
ATOM     28  C   LIG    1        7.007   0.610  -1.547  0.00  0.00    +0.120 C 
ATOM     29  C   LIG    1        7.925   1.092  -0.443  0.00  0.00    -0.030 A 
ATOM     30  C   LIG    1        7.614   0.859   0.907  0.00  0.00    -0.042 A 
ATOM     31  C   LIG    1        8.495   1.288   1.909  0.00  0.00    +0.004 A 
ATOM     32  C   LIG    1        9.690   1.922   1.572  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1       10.011   2.138   0.234  0.00  0.00    +0.000 A 
ATOM     34  C   LIG    1        6.306   0.209   1.275  0.00  0.00    +0.051 C 
ATOM     35  C   LIG    1        9.135   1.722  -0.769  0.00  0.00    +0.005 A 
ATOM     36  C   LIG    1        5.659  -0.529   0.094  0.00  0.00    +0.089 C 
ENDBRANCH  26  27
ENDBRANCH  23  26
ENDBRANCH  22  23
ENDBRANCH   2  22
TORSDOF 8