D03PQS AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 3.726 -3.988 1.954 1.00 0.00 N HETATM 2 C UNL 1 2.826 -4.675 1.141 1.00 0.00 C HETATM 3 C UNL 1 3.223 -5.212 -0.186 1.00 0.00 C HETATM 4 O UNL 1 1.684 -4.915 1.533 1.00 0.00 O HETATM 5 C UNL 1 2.432 -6.269 -0.722 1.00 0.00 C HETATM 6 C UNL 1 3.152 -7.337 -1.245 1.00 0.00 C HETATM 7 C UNL 1 4.348 -7.008 -1.857 1.00 0.00 C HETATM 8 C UNL 1 4.690 -5.677 -1.972 1.00 0.00 C HETATM 9 C UNL 1 4.275 -4.781 -1.001 1.00 0.00 C HETATM 10 O UNL 1 4.797 -3.508 -0.937 1.00 0.00 O HETATM 11 S UNL 1 3.151 -9.033 -0.592 1.00 0.00 S HETATM 12 C UNL 1 6.229 -3.376 -1.161 1.00 0.00 C HETATM 13 C UNL 1 6.649 -3.315 -2.642 1.00 0.00 C HETATM 14 C UNL 1 1.592 -9.825 -0.593 1.00 0.00 C HETATM 15 O UNL 1 3.963 -9.775 -1.546 1.00 0.00 O HETATM 16 O UNL 1 3.606 -8.892 0.788 1.00 0.00 O HETATM 17 C UNL 1 3.389 -3.609 3.308 1.00 0.00 C HETATM 18 C UNL 1 4.554 -4.545 3.799 1.00 0.00 C HETATM 19 C UNL 1 5.112 -4.306 2.353 1.00 0.00 C HETATM 20 C UNL 1 5.284 -4.047 5.125 1.00 0.00 C HETATM 21 N UNL 1 4.467 -3.304 5.923 1.00 0.00 N HETATM 22 C UNL 1 5.009 -2.247 6.548 1.00 0.00 C HETATM 23 C UNL 1 6.214 -1.774 6.096 1.00 0.00 C HETATM 24 C UNL 1 7.129 -2.816 5.928 1.00 0.00 C HETATM 25 C UNL 1 6.640 -4.007 5.399 1.00 0.00 C HETATM 26 CL UNL 1 7.564 -5.451 5.495 1.00 0.00 Cl HETATM 27 C UNL 1 6.777 -2.109 -0.465 1.00 0.00 C HETATM 28 F UNL 1 5.889 -1.535 0.371 1.00 0.00 F HETATM 29 F UNL 1 7.871 -2.432 0.273 1.00 0.00 F HETATM 30 F UNL 1 7.169 -1.159 -1.348 1.00 0.00 F HETATM 31 O UNL 1 1.478 -5.592 -1.588 1.00 0.00 O HETATM 32 C UNL 1 1.263 -5.973 -2.956 1.00 0.00 C HETATM 33 C UNL 1 5.943 -0.878 4.846 1.00 0.00 C HETATM 34 F UNL 1 4.629 -0.528 4.711 1.00 0.00 F HETATM 35 F UNL 1 6.636 0.289 4.851 1.00 0.00 F HETATM 36 F UNL 1 6.263 -1.506 3.676 1.00 0.00 F HETATM 37 H UNL 1 5.101 -7.753 -2.079 1.00 0.00 H HETATM 38 H UNL 1 5.325 -5.435 -2.796 1.00 0.00 H HETATM 39 H UNL 1 6.724 -4.231 -0.685 1.00 0.00 H HETATM 40 H UNL 1 6.004 -2.640 -3.212 1.00 0.00 H HETATM 41 H UNL 1 6.625 -4.276 -3.147 1.00 0.00 H HETATM 42 H UNL 1 7.694 -3.008 -2.748 1.00 0.00 H HETATM 43 H UNL 1 0.929 -9.464 -1.371 1.00 0.00 H HETATM 44 H UNL 1 1.142 -9.767 0.398 1.00 0.00 H HETATM 45 H UNL 1 1.802 -10.890 -0.787 1.00 0.00 H HETATM 46 H UNL 1 2.406 -3.881 3.698 1.00 0.00 H HETATM 47 H UNL 1 3.547 -2.526 3.480 1.00 0.00 H HETATM 48 H UNL 1 4.228 -5.585 3.918 1.00 0.00 H HETATM 49 H UNL 1 5.543 -5.178 1.857 1.00 0.00 H HETATM 50 H UNL 1 5.775 -3.443 2.219 1.00 0.00 H HETATM 51 H UNL 1 4.342 -1.652 7.163 1.00 0.00 H HETATM 52 H UNL 1 8.131 -2.744 6.344 1.00 0.00 H HETATM 53 H UNL 1 1.828 -5.340 -3.659 1.00 0.00 H HETATM 54 H UNL 1 0.205 -5.783 -3.173 1.00 0.00 H HETATM 55 H UNL 1 1.465 -7.024 -3.163 1.00 0.00 H CONECT 1 2 17 19 CONECT 2 1 3 4 CONECT 3 2 5 9 CONECT 4 2 CONECT 5 31 3 6 CONECT 6 5 7 11 CONECT 7 6 8 37 CONECT 8 7 9 38 CONECT 9 8 3 10 CONECT 10 9 12 CONECT 11 6 14 15 16 CONECT 12 13 10 27 39 CONECT 13 12 40 41 42 CONECT 14 11 43 44 45 CONECT 15 11 CONECT 16 11 CONECT 17 1 18 46 47 CONECT 18 17 19 20 48 CONECT 19 18 1 49 50 CONECT 20 18 21 25 CONECT 21 20 22 CONECT 22 21 23 51 CONECT 23 33 22 24 CONECT 24 23 25 52 CONECT 25 24 20 26 CONECT 26 25 CONECT 27 28 29 30 12 CONECT 28 27 CONECT 29 27 CONECT 30 27 CONECT 31 32 5 CONECT 32 31 53 54 55 CONECT 33 34 35 36 23 CONECT 34 33 CONECT 35 33 CONECT 36 33 CONECT 37 7 CONECT 38 8 CONECT 39 12 CONECT 40 13 CONECT 41 13 CONECT 42 13 CONECT 43 14 CONECT 44 14 CONECT 45 14 CONECT 46 17 CONECT 47 17 CONECT 48 18 CONECT 49 19 CONECT 50 19 CONECT 51 22 CONECT 52 24 CONECT 53 32 CONECT 54 32 CONECT 55 32 MASTER 0 0 0 0 0 0 0 0 55 0 55 0 END M END $$$$