REMARK  Name = BDB015080
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.607  -0.330  -0.787  0.00  0.00    +0.261 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1        1.005   0.970  -0.333  0.00  0.00    -0.489 OA
BRANCH   2   5
ATOM      3  C   LIG    1        4.468   0.309   0.876  0.00  0.00    -0.013 A 
ATOM      4  C   LIG    1        3.205   0.066   0.305  0.00  0.00    +0.054 A 
ATOM      5  C   LIG    1        2.257   1.086   0.204  0.00  0.00    +0.121 A 
ATOM      6  C   LIG    1        2.572   2.361   0.678  0.00  0.00    +0.045 A 
ATOM      7  C   LIG    1        3.816   2.619   1.250  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1        4.759   1.597   1.350  0.00  0.00    +0.009 A 
BRANCH   3  11
ATOM      9  C   LIG    1        6.129  -0.569  -1.466  0.00  0.00    +0.044 C 
ATOM     10  C   LIG    1        6.249  -1.194  -0.103  0.00  0.00    -0.040 A 
ATOM     11  C   LIG    1        5.460  -0.766   0.982  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1        5.655  -1.418   2.204  0.00  0.00    +0.119 A 
ATOM     13  N   LIG    1        6.533  -2.426   2.414  0.00  0.00    -0.263 NA
ATOM     14  C   LIG    1        7.263  -2.815   1.351  0.00  0.00    +0.111 A 
ATOM     15  C   LIG    1        7.158  -2.242   0.094  0.00  0.00    +0.023 A 
ENDBRANCH   3  11
ENDBRANCH   2   5
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  C   LIG    1       -0.831  -0.237  -1.324  0.00  0.00    +0.166 C 
BRANCH  16  17
ATOM     17  O   LIG    1       -0.824   0.648  -2.458  0.00  0.00    -0.387 OA
ATOM     18  H   LIG    1       -0.375   1.463  -2.164  0.00  0.00    +0.210 HD
ENDBRANCH  16  17
BRANCH  16  19
ATOM     19  C   LIG    1       -1.806   0.287  -0.240  0.00  0.00    +0.119 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -3.224  -0.088  -0.443  0.00  0.00    -0.295 NA
ATOM     21  C   LIG    1       -4.018   0.363   0.720  0.00  0.00    +0.120 C 
ATOM     22  C   LIG    1       -5.511   0.164   0.568  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1       -6.091   0.013  -0.702  0.00  0.00    -0.042 A 
ATOM     24  C   LIG    1       -7.479  -0.135  -0.822  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1       -8.291  -0.107   0.312  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -7.721   0.061   1.572  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -5.213  -0.057  -1.923  0.00  0.00    +0.051 C 
ATOM     28  C   LIG    1       -6.339   0.199   1.700  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1       -3.794   0.479  -1.675  0.00  0.00    +0.089 C 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   1  16
TORSDOF 7