REMARK  Name = BDB061152
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.850   1.966  -0.457  0.00  0.00    -0.021 A 
ATOM      2  C   LIG    1       -2.000   2.418   0.201  0.00  0.00    +0.015 A 
ATOM      3  C   LIG    1       -3.247   1.806  -0.005  0.00  0.00    -0.008 A 
ATOM      4  C   LIG    1       -4.450   2.354   0.710  0.00  0.00    +0.047 C 
ATOM      5  C   LIG    1       -3.325   0.698  -0.866  0.00  0.00    +0.128 A 
ATOM      6  C   LIG    1       -2.203   0.286  -1.603  0.00  0.00    -0.008 A 
ATOM      7  C   LIG    1       -2.265  -0.831  -2.605  0.00  0.00    +0.047 C 
ATOM      8  C   LIG    1       -0.968   0.915  -1.371  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  16
ATOM      9  C   LIG    1        5.282  -0.592   0.411  0.00  0.00    +0.124 A 
ATOM     10  C   LIG    1        3.899  -0.633   0.179  0.00  0.00    +0.092 A 
ATOM     11  C   LIG    1        3.211   0.560   0.126  0.00  0.00    +0.143 A 
ATOM     12  O   LIG    1        1.861   0.699  -0.094  0.00  0.00    -0.451 OA
ATOM     13  C   LIG    1        1.612   2.067  -0.065  0.00  0.00    +0.176 C 
ATOM     14  C   LIG    1        2.866   2.826   0.189  0.00  0.00    +0.231 C 
ATOM     15  O   LIG    1        3.034   4.022   0.282  0.00  0.00    -0.283 OA
ATOM     16  C   LIG    1        0.421   2.660  -0.220  0.00  0.00    +0.058 C 
ATOM     17  C   LIG    1        3.867   1.773   0.300  0.00  0.00    +0.068 A 
ATOM     18  C   LIG    1        5.223   1.851   0.536  0.00  0.00    +0.019 A 
ATOM     19  C   LIG    1        5.935   0.646   0.592  0.00  0.00    +0.046 A 
BRANCH   9  20
ATOM     20  O   LIG    1        5.874  -1.824   0.450  0.00  0.00    -0.492 OA
BRANCH  20  22
ATOM     21  C   LIG    1        7.730  -1.935   2.007  0.00  0.00    +0.048 C 
ATOM     22  C   LIG    1        7.294  -1.911   0.552  0.00  0.00    +0.225 C 
ENDBRANCH  20  22
ENDBRANCH   9  20
ENDBRANCH   1  16
BRANCH   5  23
ATOM     23  O   LIG    1       -4.525   0.075  -1.076  0.00  0.00    -0.475 OA
BRANCH  23  24
ATOM     24  C   LIG    1       -4.874  -1.012  -0.176  0.00  0.00    +0.200 C 
ATOM     25  C   LIG    1       -3.872  -1.369   0.931  0.00  0.00    +0.067 C 
ATOM     26  C   LIG    1       -5.144  -2.246  -1.047  0.00  0.00    +0.067 C 
BRANCH  24  27
ATOM     27  C   LIG    1       -6.226  -0.632   0.456  0.00  0.00    +0.348 C 
ATOM     28  O   LIG    1       -6.703  -1.144   1.458  0.00  0.00    -0.247 OA
BRANCH  27  29
ATOM     29  O   LIG    1       -6.885   0.328  -0.245  0.00  0.00    -0.478 OA
ATOM     30  H   LIG    1       -6.323   0.628  -0.994  0.00  0.00    +0.295 HD
ENDBRANCH  27  29
ENDBRANCH  24  27
ENDBRANCH  23  24
ENDBRANCH   5  23
TORSDOF 7