D0VA1R AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 3.380 1.362 4.343 1.00 0.00 C HETATM 2 C UNL 1 3.919 0.630 3.348 1.00 0.00 C HETATM 3 C UNL 1 3.623 0.987 1.895 1.00 0.00 C HETATM 4 C UNL 1 3.671 2.489 1.781 1.00 0.00 C HETATM 5 C UNL 1 2.959 3.222 2.661 1.00 0.00 C HETATM 6 C UNL 1 2.596 2.571 3.964 1.00 0.00 C HETATM 7 O UNL 1 1.705 3.016 4.680 1.00 0.00 O HETATM 8 C UNL 1 2.246 0.490 1.516 1.00 0.00 C HETATM 9 O UNL 1 4.579 0.366 1.086 1.00 0.00 O HETATM 10 C UNL 1 1.436 -0.238 2.381 1.00 0.00 C HETATM 11 C UNL 1 0.259 0.548 2.359 1.00 0.00 C HETATM 12 C UNL 1 0.082 0.563 0.971 1.00 0.00 C HETATM 13 N UNL 1 1.345 0.975 0.540 1.00 0.00 N HETATM 14 C UNL 1 -0.862 0.520 3.190 1.00 0.00 C HETATM 15 C UNL 1 -1.668 -0.528 2.790 1.00 0.00 C HETATM 16 C UNL 1 -1.813 -0.783 1.424 1.00 0.00 C HETATM 17 C UNL 1 -1.037 -0.098 0.446 1.00 0.00 C HETATM 18 S UNL 1 1.752 1.549 -1.002 1.00 0.00 S HETATM 19 C UNL 1 1.776 3.324 -1.156 1.00 0.00 C HETATM 20 O UNL 1 3.093 1.077 -1.230 1.00 0.00 O HETATM 21 O UNL 1 0.672 1.098 -1.881 1.00 0.00 O HETATM 22 C UNL 1 0.818 4.185 -0.628 1.00 0.00 C HETATM 23 C UNL 1 0.645 5.456 -1.209 1.00 0.00 C HETATM 24 C UNL 1 1.454 5.828 -2.284 1.00 0.00 C HETATM 25 C UNL 1 2.677 5.186 -2.394 1.00 0.00 C HETATM 26 C UNL 1 2.754 3.850 -2.019 1.00 0.00 C HETATM 27 C UNL 1 0.748 6.203 -3.590 1.00 0.00 C HETATM 28 H UNL 1 3.371 1.057 5.381 1.00 0.00 H HETATM 29 H UNL 1 4.397 -0.320 3.568 1.00 0.00 H HETATM 30 H UNL 1 4.685 2.841 1.588 1.00 0.00 H HETATM 31 H UNL 1 2.083 3.752 2.280 1.00 0.00 H HETATM 32 H UNL 1 4.303 -0.556 0.946 1.00 0.00 H HETATM 33 H UNL 1 1.746 -0.851 3.213 1.00 0.00 H HETATM 34 H UNL 1 -1.399 1.483 3.235 1.00 0.00 H HETATM 35 H UNL 1 -2.142 -1.138 3.551 1.00 0.00 H HETATM 36 H UNL 1 -2.486 -1.585 1.115 1.00 0.00 H HETATM 37 H UNL 1 -1.120 -0.348 -0.603 1.00 0.00 H HETATM 38 H UNL 1 0.110 3.870 0.132 1.00 0.00 H HETATM 39 H UNL 1 -0.210 6.078 -0.950 1.00 0.00 H HETATM 40 H UNL 1 3.589 5.749 -2.586 1.00 0.00 H HETATM 41 H UNL 1 3.564 3.244 -2.417 1.00 0.00 H HETATM 42 H UNL 1 0.263 7.179 -3.557 1.00 0.00 H HETATM 43 H UNL 1 -0.019 5.437 -3.794 1.00 0.00 H HETATM 44 H UNL 1 1.431 6.168 -4.448 1.00 0.00 H CONECT 1 2 6 28 CONECT 2 1 3 29 CONECT 3 2 4 8 9 CONECT 4 3 5 30 CONECT 5 4 6 31 CONECT 6 5 1 7 CONECT 7 6 CONECT 8 3 10 13 CONECT 9 3 32 CONECT 10 8 11 33 CONECT 11 10 12 14 CONECT 12 11 13 17 CONECT 13 12 8 18 CONECT 14 11 15 34 CONECT 15 14 16 35 CONECT 16 15 17 36 CONECT 17 16 12 37 CONECT 18 13 19 20 21 CONECT 19 18 22 26 CONECT 20 18 CONECT 21 18 CONECT 22 19 23 38 CONECT 23 22 24 39 CONECT 24 27 23 25 CONECT 25 24 26 40 CONECT 26 25 19 41 CONECT 27 24 42 43 44 CONECT 28 1 CONECT 29 2 CONECT 30 4 CONECT 31 5 CONECT 32 9 CONECT 33 10 CONECT 34 14 CONECT 35 15 CONECT 36 16 CONECT 37 17 CONECT 38 22 CONECT 39 23 CONECT 40 25 CONECT 41 26 CONECT 42 27 CONECT 43 27 CONECT 44 27 MASTER 0 0 0 0 0 0 0 0 44 0 44 0 END M END $$$$