REMARK  Name = BDB015060
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.033   1.985   0.006  0.00  0.00    +0.261 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.868   1.070   0.915  0.00  0.00    +0.166 C 
BRANCH   2   3
ATOM      3  O   LIG    1        0.659   1.458   2.284  0.00  0.00    -0.387 OA
ATOM      4  H   LIG    1       -0.310   1.510   2.398  0.00  0.00    +0.210 HD
ENDBRANCH   2   3
BRANCH   2   5
ATOM      5  C   LIG    1        2.375   1.166   0.604  0.00  0.00    +0.119 C 
BRANCH   5   6
ATOM      6  N   LIG    1        2.744   0.738  -0.760  0.00  0.00    -0.295 NA
ATOM      7  C   LIG    1        4.135   1.124  -1.081  0.00  0.00    +0.120 C 
ATOM      8  C   LIG    1        5.206   0.252  -0.460  0.00  0.00    -0.030 A 
ATOM      9  C   LIG    1        4.922  -1.064  -0.053  0.00  0.00    -0.042 A 
ATOM     10  C   LIG    1        5.941  -1.861   0.484  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1        7.239  -1.365   0.597  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1        7.528  -0.068   0.178  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        3.514  -1.597  -0.134  0.00  0.00    +0.051 C 
ATOM     14  C   LIG    1        6.518   0.736  -0.351  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1        2.592  -0.712  -0.987  0.00  0.00    +0.089 C 
ENDBRANCH   5   6
ENDBRANCH   2   5
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  O   LIG    1       -1.359   1.868   0.335  0.00  0.00    -0.489 OA
BRANCH  16  17
ATOM     17  C   LIG    1       -2.086   0.855  -0.226  0.00  0.00    +0.121 A 
ATOM     18  C   LIG    1       -3.403   0.764   0.241  0.00  0.00    +0.054 A 
ATOM     19  C   LIG    1       -4.279  -0.228  -0.227  0.00  0.00    -0.013 A 
ATOM     20  C   LIG    1       -3.808  -1.131  -1.190  0.00  0.00    +0.009 A 
ATOM     21  C   LIG    1       -2.499  -1.045  -1.663  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1       -1.639  -0.054  -1.183  0.00  0.00    +0.045 A 
BRANCH  19  23
ATOM     23  C   LIG    1       -5.661  -0.303   0.269  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1       -6.102  -1.292   1.169  0.00  0.00    +0.049 A 
ATOM     25 CL   LIG    1       -5.035  -2.506   1.791  0.00  0.00    -0.083 Cl
ATOM     26  C   LIG    1       -7.431  -1.319   1.608  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1       -8.339  -0.362   1.159  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1       -7.921   0.625   0.271  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -6.595   0.654  -0.168  0.00  0.00    +0.010 A 
ENDBRANCH  19  23
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 7