REMARK  Name = BDB064739
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.095  -1.513   2.179  0.00  0.00    -0.014 A 
ATOM      2  C   LIG    1        1.308  -1.646   2.305  0.00  0.00    -0.018 A 
ATOM      3  C   LIG    1        1.859  -2.056   3.530  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1        1.038  -2.324   4.626  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1       -0.339  -2.192   4.493  0.00  0.00    +0.117 A 
ATOM      6  C   LIG    1       -0.908  -1.797   3.286  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1       -1.643  -0.176   0.772  0.00  0.00    +0.068 C 
ATOM      8  C   LIG    1       -0.711  -1.133   0.894  0.00  0.00    +0.014 C 
BRANCH   7  11
ATOM      9  N   LIG    1       -3.260   0.967  -0.546  0.00  0.00    -0.312 N 
ATOM     10  H   LIG    1       -3.777   1.018   0.321  0.00  0.00    +0.149 HD
ATOM     11  C   LIG    1       -2.109   0.217  -0.581  0.00  0.00    +0.237 C 
ATOM     12  O   LIG    1       -1.517  -0.101  -1.604  0.00  0.00    -0.271 OA
BRANCH   9  13
ATOM     13  C   LIG    1       -3.949   1.318  -1.771  0.00  0.00    +0.104 C 
BRANCH  13  15
ATOM     14  C   LIG    1       -5.659   2.833  -2.826  0.00  0.00    +0.005 C 
ATOM     15  C   LIG    1       -4.930   2.462  -1.546  0.00  0.00    +0.015 C 
ENDBRANCH  13  15
ENDBRANCH   9  13
ENDBRANCH   7  11
ENDBRANCH   1   8
BRANCH   2  16
ATOM     16  C   LIG    1        2.239  -1.387   1.195  0.00  0.00    +0.009 C 
ATOM     17  C   LIG    1        2.330  -0.182   0.613  0.00  0.00    +0.009 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.134   0.039  -0.588  0.00  0.00    -0.018 A 
ATOM     19  C   LIG    1        4.532  -0.022  -0.556  0.00  0.00    +0.053 A 
ATOM     20  C   LIG    1        5.253   0.198  -1.729  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1        4.604   0.472  -2.928  0.00  0.00    +0.090 A 
ATOM     22  C   LIG    1        3.216   0.526  -2.952  0.00  0.00    +0.121 A 
ATOM     23  C   LIG    1        2.474   0.317  -1.792  0.00  0.00    +0.053 A 
BRANCH  20  24
ATOM     24  O   LIG    1        6.617   0.151  -1.740  0.00  0.00    -0.507 OA
ATOM     25  H   LIG    1        6.929  -0.040  -0.841  0.00  0.00    +0.292 HD
ENDBRANCH  20  24
BRANCH  22  26
ATOM     26  O   LIG    1        2.602   0.787  -4.142  0.00  0.00    -0.507 OA
ATOM     27  H   LIG    1        1.639   0.737  -4.007  0.00  0.00    +0.292 HD
ENDBRANCH  22  26
ENDBRANCH  17  18
ENDBRANCH   2  16
BRANCH   5  28
ATOM     28  O   LIG    1       -1.180  -2.450   5.535  0.00  0.00    -0.507 OA
ATOM     29  H   LIG    1       -0.652  -2.734   6.300  0.00  0.00    +0.292 HD
ENDBRANCH   5  28
TORSDOF 9