REMARK  Name = BDB017275
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.300  -0.400  -0.670  0.00  0.00    +0.018 A 
ATOM      2  C   LIG    1        1.250   0.233  -1.485  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1        2.600   0.306  -1.105  0.00  0.00    -0.017 A 
ATOM      4  C   LIG    1        3.008  -0.260   0.120  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        4.362  -0.184   0.500  0.00  0.00    +0.018 A 
ATOM      6  C   LIG    1        5.330   0.444  -0.307  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        4.896   0.989  -1.527  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1        2.051  -0.886   0.934  0.00  0.00    +0.009 A 
ATOM      9  C   LIG    1        3.555   0.926  -1.920  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1        0.709  -0.955   0.546  0.00  0.00    +0.012 A 
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1        6.751   0.530   0.091  0.00  0.00    +0.071 A 
ATOM     12  N   LIG    1        7.651   0.480  -0.925  0.00  0.00    -0.255 NA
ATOM     13  C   LIG    1        8.964   0.551  -0.614  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1        9.444   0.678   0.676  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        8.521   0.739   1.711  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        7.160   0.665   1.418  0.00  0.00    +0.028 A 
ENDBRANCH   6  11
BRANCH   1  18
ATOM     17  O   LIG    1       -1.454   0.307  -2.063  0.00  0.00    -0.292 OA
ATOM     18  C   LIG    1       -1.120  -0.439  -1.143  0.00  0.00    +0.166 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.118  -1.381  -0.465  0.00  0.00    +0.060 C 
ATOM     20  C   LIG    1       -2.789  -0.672   0.728  0.00  0.00    +0.015 C 
ATOM     21  C   LIG    1       -4.168  -0.084   0.370  0.00  0.00    -0.010 C 
ATOM     22  C   LIG    1       -5.119  -1.209  -0.091  0.00  0.00    +0.003 C 
ATOM     23  C   LIG    1       -4.413  -2.374  -0.790  0.00  0.00    +0.001 C 
ATOM     24  C   LIG    1       -3.136  -1.923  -1.483  0.00  0.00    +0.011 C 
BRANCH  21  25
ATOM     25  C   LIG    1       -4.732   0.706   1.567  0.00  0.00    +0.007 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -5.815   1.716   1.300  0.00  0.00    -0.011 C 
ATOM     27  C   LIG    1       -6.377   2.052  -0.060  0.00  0.00    +0.004 C 
ATOM     28  C   LIG    1       -7.212   1.286   0.928  0.00  0.00    +0.004 C 
ENDBRANCH  25  26
ENDBRANCH  21  25
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 5