REMARK  Name = BDB015846
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.812   2.096  -0.043  0.00  0.00    +0.164 A 
ATOM      2  N   LIG    1       -0.172   1.257   0.324  0.00  0.00    -0.193 NA
ATOM      3  C   LIG    1       -1.442   1.708   0.212  0.00  0.00    +0.228 A 
ATOM      4  C   LIG    1       -1.776   2.966  -0.261  0.00  0.00    +0.082 A 
ATOM      5  C   LIG    1       -0.683   3.744  -0.591  0.00  0.00    +0.128 A 
ATOM      6  N   LIG    1        0.607   3.343  -0.497  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.798  -0.218   0.503  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.485   0.275   0.427  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.202   1.604   0.046  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        3.298   2.433  -0.254  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.610   1.961  -0.177  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.858   0.642   0.199  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        5.765  -4.760   0.916  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        4.915  -3.603   1.058  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        3.816  -3.680   1.829  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        3.283  -2.459   1.733  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.032  -1.597   0.897  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.087  -2.380   0.476  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.133   3.480  -0.422  0.00  0.00    +0.099 A 
ATOM     20  N   LIG    1       -3.360   4.804  -0.515  0.00  0.00    -0.171 NA
ATOM     21  N   LIG    1       -4.692   4.917  -0.653  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -5.285   6.227  -0.764  0.00  0.00    +0.172 C 
ATOM     23  C   LIG    1       -5.338   3.722  -0.680  0.00  0.00    +0.108 A 
ATOM     24  C   LIG    1       -4.359   2.768  -0.537  0.00  0.00    +0.049 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  O   LIG    1       -2.458   0.858   0.601  0.00  0.00    -0.473 OA
BRANCH  25  26
ATOM     26  C   LIG    1       -2.039  -0.405   1.139  0.00  0.00    +0.262 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -1.707  -1.416   0.029  0.00  0.00    +0.156 C 
ATOM     28  O   LIG    1       -2.929  -1.781  -0.638  0.00  0.00    -0.373 OA
ATOM     29  C   LIG    1       -2.699  -2.664  -1.736  0.00  0.00    +0.160 C 
ATOM     30  C   LIG    1       -2.084  -3.972  -1.256  0.00  0.00    +0.028 C 
ATOM     31  C   LIG    1       -0.808  -3.712  -0.464  0.00  0.00    +0.005 C 
ATOM     32  C   LIG    1       -1.055  -2.668   0.621  0.00  0.00    +0.035 C 
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH   3  25
TORSDOF 6