REMARK  Name = BDB015016
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.515  -0.152  -0.258  0.00  0.00    +0.166 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1        0.089   0.654  -1.281  0.00  0.00    -0.387 OA
ATOM      3  H   LIG    1       -0.659   0.941  -1.845  0.00  0.00    +0.210 HD
ENDBRANCH   1   2
BRANCH   1   4
ATOM      4  C   LIG    1       -1.862   0.499   0.128  0.00  0.00    +0.119 C 
BRANCH   4   5
ATOM      5  N   LIG    1       -2.706   0.782  -1.058  0.00  0.00    -0.295 NA
ATOM      6  C   LIG    1       -3.866   1.622  -0.690  0.00  0.00    +0.120 C 
ATOM      7  C   LIG    1       -4.979   0.891   0.031  0.00  0.00    -0.030 A 
ATOM      8  C   LIG    1       -5.137  -0.501  -0.105  0.00  0.00    -0.042 A 
ATOM      9  C   LIG    1       -6.197  -1.148   0.543  0.00  0.00    +0.004 A 
ATOM     10  C   LIG    1       -7.109  -0.417   1.304  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1       -6.966   0.963   1.426  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -4.135  -1.306  -0.895  0.00  0.00    +0.051 C 
ATOM     13  C   LIG    1       -5.910   1.616   0.790  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1       -3.203  -0.427  -1.743  0.00  0.00    +0.089 C 
ENDBRANCH   4   5
ENDBRANCH   1   4
BRANCH   1  15
ATOM     15  C   LIG    1        0.413  -0.254   0.961  0.00  0.00    +0.261 C 
BRANCH  15  16
ATOM     16  O   LIG    1        1.411  -1.264   0.754  0.00  0.00    -0.489 OA
BRANCH  16  17
ATOM     17  C   LIG    1        2.696  -0.864   0.530  0.00  0.00    +0.121 A 
ATOM     18  C   LIG    1        3.089   0.352  -0.021  0.00  0.00    +0.046 A 
ATOM     19  C   LIG    1        4.447   0.633  -0.217  0.00  0.00    +0.013 A 
ATOM     20  C   LIG    1        5.435  -0.299   0.129  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        5.030  -1.529   0.661  0.00  0.00    +0.013 A 
ATOM     22  C   LIG    1        3.672  -1.808   0.853  0.00  0.00    +0.046 A 
BRANCH  20  23
ATOM     23  C   LIG    1        6.848   0.012  -0.078  0.00  0.00    +0.066 A 
ATOM     24  N   LIG    1        7.860  -0.458   0.723  0.00  0.00    -0.277 N 
ATOM     25  H   LIG    1        7.777  -1.050   1.542  0.00  0.00    +0.189 HD
ATOM     26  N   LIG    1        9.087  -0.048   0.360  0.00  0.00    -0.182 NA
ATOM     27  C   LIG    1        8.855   0.722  -0.704  0.00  0.00    +0.135 A 
ATOM     28  C   LIG    1        7.487   0.801  -1.016  0.00  0.00    +0.049 A 
ENDBRANCH  20  23
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 7