REMARK  Name = BDB015933
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.078   1.581   0.977  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.552   0.676   0.199  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.847   0.886  -0.117  0.00  0.00    +0.132 A 
ATOM      4  C   LIG    1       -2.515   2.037   0.308  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1       -1.783   2.886   1.118  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1       -0.498   2.687   1.471  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.601   0.116   0.913  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.255   0.374   0.609  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.497   1.337   1.306  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.151   2.055   2.323  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        3.491   1.816   2.636  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.211   0.849   1.936  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        6.815  -3.462  -0.332  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        5.757  -2.482  -0.362  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        5.020  -2.339  -1.478  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        4.155  -1.373  -1.156  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.331  -0.894   0.165  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.384  -1.644   0.649  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.888   2.384  -0.044  0.00  0.00    +0.097 A 
ATOM     20  N   LIG    1       -4.685   3.035   0.822  0.00  0.00    -0.171 NA
ATOM     21  N   LIG    1       -5.849   3.188   0.167  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -6.950   3.849   0.824  0.00  0.00    +0.172 C 
ATOM     23  C   LIG    1       -5.833   2.681  -1.095  0.00  0.00    +0.108 A 
ATOM     24  C   LIG    1       -4.574   2.158  -1.269  0.00  0.00    +0.049 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.514  -0.070  -0.903  0.00  0.00    -0.323 N 
ATOM     26  H   LIG    1       -3.402  -0.278  -0.444  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.868  -1.323  -1.301  0.00  0.00    +0.100 C 
ATOM     28  C   LIG    1       -1.413  -2.236  -0.140  0.00  0.00    +0.135 C 
ATOM     29  C   LIG    1       -0.071  -2.829  -0.584  0.00  0.00    +0.033 C 
ATOM     30  C   LIG    1        0.038  -2.518  -2.074  0.00  0.00    +0.004 C 
ATOM     31  C   LIG    1       -0.666  -1.176  -2.228  0.00  0.00    +0.025 C 
BRANCH  28  32
ATOM     32  O   LIG    1       -2.374  -3.274   0.082  0.00  0.00    -0.390 OA
ATOM     33  H   LIG    1       -2.333  -3.889  -0.670  0.00  0.00    +0.210 HD
ENDBRANCH  28  32
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 6