REMARK  Name = BDB032274
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.672   0.937  -1.103  0.00  0.00    +0.119 A 
ATOM      2  N   LIG    1       -0.029   0.785   0.071  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1        1.322   0.694   0.051  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1        2.095   0.757  -1.101  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1        1.416   0.898  -2.309  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        0.024   0.986  -2.309  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1       -2.076   1.007  -1.150  0.00  0.00    -0.329 N 
ATOM      8  H   LIG    1       -2.339   1.826  -1.690  0.00  0.00    +0.147 HD
BRANCH   7   9
ATOM      9  C   LIG    1       -2.724   0.986   0.162  0.00  0.00    +0.106 C 
BRANCH   9  14
ATOM     10  C   LIG    1       -7.614  -1.300   0.964  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1       -6.295  -0.772   1.303  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1       -5.248  -1.286   0.407  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1       -4.798  -0.279  -0.650  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1       -4.254   1.014  -0.012  0.00  0.00    +0.008 C 
ATOM     15  C   LIG    1       -4.927   1.291   1.346  0.00  0.00    +0.020 C 
ATOM     16  C   LIG    1       -6.330   0.693   1.400  0.00  0.00    +0.084 C 
ENDBRANCH   9  14
ENDBRANCH   7   9
ENDBRANCH   1   7
BRANCH   4  17
ATOM     17  C   LIG    1        3.591   0.655  -1.033  0.00  0.00    +0.138 C 
BRANCH  17  18
ATOM     18  N   LIG    1        3.965  -0.715  -0.680  0.00  0.00    -0.337 N 
ATOM     19  H   LIG    1        3.589  -1.364  -1.375  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1        5.371  -0.873  -0.629  0.00  0.00    +0.075 A 
ATOM     21  C   LIG    1        6.101  -0.765   0.574  0.00  0.00    +0.042 A 
ATOM     22  C   LIG    1        7.487  -0.892   0.514  0.00  0.00    +0.140 A 
ATOM     23  N   LIG    1        7.979  -0.757   1.784  0.00  0.00    -0.346 N 
ATOM     24  H   LIG    1        8.961  -0.814   2.012  0.00  0.00    +0.167 HD
ATOM     25  C   LIG    1        6.949  -0.541   2.663  0.00  0.00    +0.085 A 
ATOM     26  N   LIG    1        8.250  -1.107  -0.575  0.00  0.00    -0.235 NA
ATOM     27  C   LIG    1        7.516  -1.199  -1.709  0.00  0.00    +0.153 A 
ATOM     28  C   LIG    1        5.774  -0.543   1.942  0.00  0.00    +0.031 A 
ATOM     29  C   LIG    1        6.135  -1.087  -1.787  0.00  0.00    +0.163 A 
ATOM     30  F   LIG    1        5.526  -1.183  -2.980  0.00  0.00    -0.202 F 
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 6