REMARK  Name = BDB064763
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.302  -0.742  -0.551  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        1.024  -0.205  -0.370  0.00  0.00    +0.034 A 
ATOM      3  C   LIG    1       -0.108  -0.828  -0.921  0.00  0.00    +0.018 A 
ATOM      4  C   LIG    1        0.064  -1.994  -1.679  0.00  0.00    +0.124 A 
ATOM      5  C   LIG    1        1.329  -2.539  -1.863  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1        2.445  -1.916  -1.301  0.00  0.00    +0.027 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1        3.587   0.957   0.759  0.00  0.00    +0.241 C 
ATOM      8  N   LIG    1        3.480  -0.168  -0.028  0.00  0.00    -0.282 N 
ATOM      9  H   LIG    1        4.337  -0.668  -0.222  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1        2.679   1.645   1.209  0.00  0.00    -0.271 OA
BRANCH   7  13
ATOM     11  C   LIG    1        7.435   1.572   0.715  0.00  0.00    +0.035 C 
ATOM     12  C   LIG    1        6.049   1.172   0.323  0.00  0.00    -0.025 C 
ATOM     13  C   LIG    1        4.987   1.300   1.135  0.00  0.00    +0.063 C 
ENDBRANCH   7  13
ENDBRANCH   1   8
BRANCH   3  14
ATOM     14  C   LIG    1       -1.417  -0.208  -0.677  0.00  0.00    +0.012 C 
ATOM     15  C   LIG    1       -2.375  -0.824   0.035  0.00  0.00    +0.009 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -3.689  -0.229   0.312  0.00  0.00    -0.018 A 
ATOM     17  C   LIG    1       -3.835   1.120   0.665  0.00  0.00    +0.053 A 
ATOM     18  C   LIG    1       -5.101   1.631   0.944  0.00  0.00    +0.121 A 
ATOM     19  C   LIG    1       -6.231   0.824   0.888  0.00  0.00    +0.090 A 
ATOM     20  C   LIG    1       -6.080  -0.517   0.555  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1       -4.824  -1.049   0.275  0.00  0.00    +0.053 A 
BRANCH  18  22
ATOM     22  O   LIG    1       -5.277   2.941   1.288  0.00  0.00    -0.507 OA
ATOM     23  H   LIG    1       -4.408   3.374   1.318  0.00  0.00    +0.292 HD
ENDBRANCH  18  22
BRANCH  20  24
ATOM     24  O   LIG    1       -7.153  -1.358   0.493  0.00  0.00    -0.507 OA
ATOM     25  H   LIG    1       -7.953  -0.853   0.719  0.00  0.00    +0.292 HD
ENDBRANCH  20  24
ENDBRANCH  15  16
ENDBRANCH   3  14
BRANCH   4  26
ATOM     26  O   LIG    1       -0.972  -2.649  -2.286  0.00  0.00    -0.506 OA
ATOM     27  H   LIG    1       -1.779  -2.119  -2.166  0.00  0.00    +0.292 HD
ENDBRANCH   4  26
TORSDOF 7