REMARK  Name = BDB003120
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.594   1.598   0.201  0.00  0.00    +0.012 C 
ATOM      2  C   LIG    1       -0.582   0.964   0.323  0.00  0.00    +0.052 C 
ENDROOT
BRANCH   1   6
ATOM      3  C   LIG    1        4.438  -0.297   0.037  0.00  0.00    +0.059 A 
ATOM      4  C   LIG    1        3.339  -0.894  -0.594  0.00  0.00    +0.015 A 
ATOM      5  C   LIG    1        2.078  -0.290  -0.544  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        1.893   0.915   0.146  0.00  0.00    -0.025 A 
ATOM      7  C   LIG    1        2.998   1.518   0.761  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1        4.261   0.916   0.714  0.00  0.00    +0.015 A 
BRANCH   3   9
ATOM      9  C   LIG    1        5.756  -0.983  -0.047  0.00  0.00    +0.339 C 
ATOM     10  O   LIG    1        5.927  -2.043  -0.629  0.00  0.00    -0.245 OA
BRANCH   9  12
ATOM     11  C   LIG    1        8.007  -0.870   0.564  0.00  0.00    +0.280 C 
ATOM     12  O   LIG    1        6.710  -0.272   0.603  0.00  0.00    -0.464 OA
ENDBRANCH   9  12
ENDBRANCH   3   9
ENDBRANCH   1   6
BRANCH   2  13
ATOM     13  C   LIG    1       -1.838   1.762   0.405  0.00  0.00    +0.186 C 
ATOM     14  O   LIG    1       -1.823   2.980   0.547  0.00  0.00    -0.287 OA
BRANCH  13  15
ATOM     15  C   LIG    1       -3.133   1.032   0.350  0.00  0.00    +0.022 A 
ATOM     16  C   LIG    1       -4.234   1.594   1.007  0.00  0.00    +0.015 A 
ATOM     17  C   LIG    1       -5.472   0.947   0.980  0.00  0.00    +0.046 A 
ATOM     18  C   LIG    1       -5.632  -0.257   0.290  0.00  0.00    +0.120 A 
ATOM     19  C   LIG    1       -4.540  -0.809  -0.382  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1       -3.295  -0.166  -0.356  0.00  0.00    +0.015 A 
BRANCH  18  21
ATOM     21  O   LIG    1       -6.893  -0.781   0.344  0.00  0.00    -0.495 OA
ATOM     22  C   LIG    1       -7.116  -2.001  -0.352  0.00  0.00    +0.277 C 
ENDBRANCH  18  21
ENDBRANCH  13  15
ENDBRANCH   2  13
TORSDOF 6