REMARK  Name = BDB061983
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.772   0.469   0.375  0.00  0.00    +0.036 A 
ATOM      2  C   LIG    1        2.752   0.037  -0.487  0.00  0.00    +0.055 A 
ATOM      3  C   LIG    1        1.418   0.283  -0.126  0.00  0.00    +0.112 A 
ATOM      4  C   LIG    1        1.153   0.939   1.063  0.00  0.00    +0.156 A 
ATOM      5  O   LIG    1       -0.199   1.056   1.187  0.00  0.00    -0.435 OA
ATOM      6  C   LIG    1       -0.690   0.457   0.052  0.00  0.00    +0.228 A 
ATOM      7  C   LIG    1        2.120   1.383   1.952  0.00  0.00    +0.050 A 
ATOM      8  N   LIG    1        0.239  -0.019  -0.760  0.00  0.00    -0.209 NA
ATOM      9  C   LIG    1        3.446   1.129   1.575  0.00  0.00    +0.027 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1       -2.143   0.428  -0.100  0.00  0.00    +0.037 A 
ATOM     11  C   LIG    1       -3.003   0.979   0.861  0.00  0.00    +0.013 A 
ATOM     12  C   LIG    1       -4.391   0.936   0.688  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1       -4.948   0.346  -0.452  0.00  0.00    -0.048 A 
ATOM     14  C   LIG    1       -4.095  -0.211  -1.411  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1       -2.708  -0.168  -1.237  0.00  0.00    +0.013 A 
BRANCH  13  16
ATOM     16  C   LIG    1       -6.444   0.284  -0.630  0.00  0.00    +0.032 C 
ATOM     17  C   LIG    1       -7.034  -0.979  -0.022  0.00  0.00    +0.009 C 
ENDBRANCH  13  16
ENDBRANCH   6  10
BRANCH   1  19
ATOM     18  C   LIG    1        5.713  -0.292  -1.006  0.00  0.00    +0.241 C 
ATOM     19  N   LIG    1        5.146   0.271   0.115  0.00  0.00    -0.282 N 
ATOM     20  H   LIG    1        5.785   0.625   0.814  0.00  0.00    +0.155 HD
ATOM     21  O   LIG    1        5.143  -0.666  -2.023  0.00  0.00    -0.271 OA
BRANCH  18  23
ATOM     22  C   LIG    1        7.927  -0.608   0.140  0.00  0.00    +0.013 C 
ATOM     23  C   LIG    1        7.200  -0.374  -0.960  0.00  0.00    +0.060 C 
ENDBRANCH  18  23
ENDBRANCH   1  19
TORSDOF 4