REMARK  Name = BDB015024
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.763   1.474   2.531  0.00  0.00    +0.261 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.527   1.757   1.229  0.00  0.00    +0.166 C 
BRANCH   2   3
ATOM      3  O   LIG    1       -1.295   3.113   0.814  0.00  0.00    -0.387 OA
ATOM      4  H   LIG    1       -2.024   3.313   0.193  0.00  0.00    +0.210 HD
ENDBRANCH   2   3
BRANCH   2   5
ATOM      5  C   LIG    1       -3.046   1.567   1.433  0.00  0.00    +0.119 C 
BRANCH   5  14
ATOM      6  C   LIG    1       -4.278  -0.288  -2.924  0.00  0.00    +0.014 C 
ATOM      7  C   LIG    1       -4.743   0.641  -1.799  0.00  0.00    +0.030 C 
ATOM      8  C   LIG    1       -5.812   0.067  -0.884  0.00  0.00    -0.039 A 
ATOM      9  C   LIG    1       -6.033   0.775   0.315  0.00  0.00    -0.030 A 
ATOM     10  C   LIG    1       -6.993   0.331   1.230  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1       -7.730  -0.820   0.958  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -7.520  -1.520  -0.231  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -5.258   2.053   0.530  0.00  0.00    +0.120 C 
ATOM     14  N   LIG    1       -3.818   1.944   0.226  0.00  0.00    -0.295 NA
ATOM     15  C   LIG    1       -6.569  -1.077  -1.152  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1       -3.531   1.036  -0.915  0.00  0.00    +0.092 C 
ENDBRANCH   5  14
ENDBRANCH   2   5
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  O   LIG    1        0.643   1.338   2.299  0.00  0.00    -0.489 OA
BRANCH  17  18
ATOM     18  C   LIG    1        1.130   0.129   1.885  0.00  0.00    +0.121 A 
ATOM     19  C   LIG    1        2.510   0.114   1.658  0.00  0.00    +0.050 A 
ATOM     20  C   LIG    1        3.164  -1.051   1.229  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1        2.406  -2.209   1.019  0.00  0.00    +0.005 A 
ATOM     22  C   LIG    1        1.030  -2.202   1.243  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        0.393  -1.036   1.677  0.00  0.00    +0.045 A 
BRANCH  20  24
ATOM     24  C   LIG    1        4.652  -1.052   0.976  0.00  0.00    +0.116 C 
BRANCH  24  25
ATOM     25  N   LIG    1        4.930  -1.123  -0.457  0.00  0.00    -0.309 NA
ATOM     26  H   LIG    1        4.471  -0.337  -0.918  0.00  0.00    +0.123 HD
BRANCH  25  27
ATOM     27  C   LIG    1        6.357  -1.118  -0.751  0.00  0.00    +0.054 C 
ATOM     28  C   LIG    1        6.610  -1.317  -2.246  0.00  0.00    +0.019 C 
ATOM     29  C   LIG    1        8.067  -0.901  -2.425  0.00  0.00    +0.002 C 
ATOM     30  C   LIG    1        8.353   0.110  -1.313  0.00  0.00    +0.002 C 
ATOM     31  C   LIG    1        7.071   0.209  -0.490  0.00  0.00    +0.019 C 
ENDBRANCH  25  27
ENDBRANCH  24  25
ENDBRANCH  20  24
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 9