D0OR2V AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.988 -1.850 2.604 1.00 0.00 C HETATM 2 C UNL 1 2.125 -2.028 1.811 1.00 0.00 C HETATM 3 C UNL 1 2.457 -1.022 0.893 1.00 0.00 C HETATM 4 C UNL 1 1.807 0.193 0.972 1.00 0.00 C HETATM 5 C UNL 1 1.128 0.434 2.154 1.00 0.00 C HETATM 6 C UNL 1 0.322 -0.626 2.567 1.00 0.00 C HETATM 7 N UNL 1 -1.033 -0.615 2.122 1.00 0.00 N HETATM 8 S UNL 1 -2.393 -1.051 2.981 1.00 0.00 S HETATM 9 F UNL 1 0.477 -2.877 3.292 1.00 0.00 F HETATM 10 F UNL 1 3.392 -1.225 -0.034 1.00 0.00 F HETATM 11 F UNL 1 1.959 1.139 0.033 1.00 0.00 F HETATM 12 N UNL 1 2.019 0.891 3.264 1.00 0.00 N HETATM 13 C UNL 1 3.016 1.904 3.252 1.00 0.00 C HETATM 14 C UNL 1 3.030 2.905 2.288 1.00 0.00 C HETATM 15 C UNL 1 3.433 4.182 2.653 1.00 0.00 C HETATM 16 C UNL 1 3.921 4.411 3.939 1.00 0.00 C HETATM 17 C UNL 1 4.208 3.346 4.787 1.00 0.00 C HETATM 18 C UNL 1 3.769 2.084 4.423 1.00 0.00 C HETATM 19 F UNL 1 3.907 1.071 5.295 1.00 0.00 F HETATM 20 I UNL 1 3.992 6.355 4.658 1.00 0.00 I HETATM 21 O UNL 1 -3.068 0.234 3.128 1.00 0.00 O HETATM 22 O UNL 1 -3.022 -2.099 2.227 1.00 0.00 O HETATM 23 C UNL 1 -2.226 -1.648 4.703 1.00 0.00 C HETATM 24 C UNL 1 -1.275 -0.822 5.542 1.00 0.00 C HETATM 25 C UNL 1 -2.795 -2.996 5.129 1.00 0.00 C HETATM 26 C UNL 1 -3.702 -1.815 5.154 1.00 0.00 C HETATM 27 C UNL 1 -0.890 -1.390 6.911 1.00 0.00 C HETATM 28 C UNL 1 -0.075 -2.696 6.906 1.00 0.00 C HETATM 29 O UNL 1 0.155 -3.113 8.252 1.00 0.00 O HETATM 30 O UNL 1 -0.068 -0.406 7.581 1.00 0.00 O HETATM 31 H UNL 1 2.673 -2.957 1.813 1.00 0.00 H HETATM 32 H UNL 1 -1.295 0.191 1.543 1.00 0.00 H HETATM 33 H UNL 1 1.415 1.095 4.065 1.00 0.00 H HETATM 34 H UNL 1 2.596 2.770 1.307 1.00 0.00 H HETATM 35 H UNL 1 3.248 4.996 1.957 1.00 0.00 H HETATM 36 H UNL 1 4.645 3.490 5.769 1.00 0.00 H HETATM 37 H UNL 1 -1.722 0.156 5.685 1.00 0.00 H HETATM 38 H UNL 1 -0.355 -0.651 4.996 1.00 0.00 H HETATM 39 H UNL 1 -2.638 -3.414 6.118 1.00 0.00 H HETATM 40 H UNL 1 -2.915 -3.755 4.370 1.00 0.00 H HETATM 41 H UNL 1 -4.001 -1.349 6.084 1.00 0.00 H HETATM 42 H UNL 1 -4.508 -1.854 4.425 1.00 0.00 H HETATM 43 H UNL 1 -1.781 -1.508 7.544 1.00 0.00 H HETATM 44 H UNL 1 0.900 -2.549 6.440 1.00 0.00 H HETATM 45 H UNL 1 -0.573 -3.519 6.393 1.00 0.00 H HETATM 46 H UNL 1 0.232 -2.302 8.793 1.00 0.00 H HETATM 47 H UNL 1 0.804 -0.393 7.164 1.00 0.00 H CONECT 1 2 6 9 CONECT 2 1 3 31 CONECT 3 2 4 10 CONECT 4 3 5 11 CONECT 5 4 6 12 CONECT 6 5 1 7 CONECT 7 6 8 32 CONECT 8 7 21 22 23 CONECT 9 1 CONECT 10 3 CONECT 11 4 CONECT 12 5 13 33 CONECT 13 12 14 18 CONECT 14 13 15 34 CONECT 15 14 16 35 CONECT 16 15 17 20 CONECT 17 16 18 36 CONECT 18 17 13 19 CONECT 19 18 CONECT 20 16 CONECT 21 8 CONECT 22 8 CONECT 23 8 24 25 26 CONECT 24 23 27 37 38 CONECT 25 23 26 39 40 CONECT 26 25 23 41 42 CONECT 27 24 28 30 43 CONECT 28 27 29 44 45 CONECT 29 28 46 CONECT 30 27 47 CONECT 31 2 CONECT 32 7 CONECT 33 12 CONECT 34 14 CONECT 35 15 CONECT 36 17 CONECT 37 24 CONECT 38 24 CONECT 39 25 CONECT 40 25 CONECT 41 26 CONECT 42 26 CONECT 43 27 CONECT 44 28 CONECT 45 28 CONECT 46 29 CONECT 47 30 MASTER 0 0 0 0 0 0 0 0 47 0 47 0 END M END $$$$