D0H0QR AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -6.077 -6.475 -8.172 1.00 0.00 C HETATM 2 C UNL 1 -7.369 -6.687 -8.628 1.00 0.00 C HETATM 3 C UNL 1 -8.215 -7.541 -7.914 1.00 0.00 C HETATM 4 C UNL 1 -7.714 -8.070 -6.734 1.00 0.00 C HETATM 5 C UNL 1 -6.362 -8.382 -6.835 1.00 0.00 C HETATM 6 C UNL 1 -5.550 -7.317 -7.186 1.00 0.00 C HETATM 7 C UNL 1 -5.993 -9.605 -7.774 1.00 0.00 C HETATM 8 N UNL 1 -8.367 -7.853 -5.518 1.00 0.00 N HETATM 9 C UNL 1 -7.646 -7.797 -4.223 1.00 0.00 C HETATM 10 C UNL 1 -8.413 -7.035 -3.079 1.00 0.00 C HETATM 11 N UNL 1 -9.130 -5.802 -3.541 1.00 0.00 N HETATM 12 C UNL 1 -9.977 -6.069 -4.775 1.00 0.00 C HETATM 13 C UNL 1 -9.775 -7.454 -5.433 1.00 0.00 C HETATM 14 S UNL 1 -9.888 -4.826 -2.327 1.00 0.00 S HETATM 15 C UNL 1 -8.600 -3.626 -1.743 1.00 0.00 C HETATM 16 O UNL 1 -10.900 -4.083 -3.049 1.00 0.00 O HETATM 17 O UNL 1 -10.259 -5.700 -1.237 1.00 0.00 O HETATM 18 C UNL 1 -9.190 -2.403 -0.941 1.00 0.00 C HETATM 19 C UNL 1 -9.822 -2.824 0.721 1.00 0.00 C HETATM 20 C UNL 1 -10.543 -1.516 1.154 1.00 0.00 C HETATM 21 C UNL 1 -10.012 -0.582 0.080 1.00 0.00 C HETATM 22 C UNL 1 -10.521 -0.225 -1.335 1.00 0.00 C HETATM 23 C UNL 1 -9.989 -1.487 -2.054 1.00 0.00 C HETATM 24 C UNL 1 -8.442 -1.182 -0.365 1.00 0.00 C HETATM 25 C UNL 1 -7.201 -1.815 0.332 1.00 0.00 C HETATM 26 C UNL 1 -7.742 0.076 -0.945 1.00 0.00 C HETATM 27 N UNL 1 -8.927 -2.880 1.977 1.00 0.00 N HETATM 28 C UNL 1 -8.133 -3.740 2.671 1.00 0.00 C HETATM 29 C UNL 1 -7.377 -3.016 3.899 1.00 0.00 C HETATM 30 O UNL 1 -7.952 -4.912 2.373 1.00 0.00 O HETATM 31 C UNL 1 -7.543 -3.693 5.268 1.00 0.00 C HETATM 32 C UNL 1 -7.001 -5.108 5.387 1.00 0.00 C HETATM 33 S UNL 1 -5.221 -5.210 5.296 1.00 0.00 S HETATM 34 C UNL 1 -4.930 -6.943 5.525 1.00 0.00 C HETATM 35 O UNL 1 -4.798 -4.866 3.952 1.00 0.00 O HETATM 36 O UNL 1 -4.672 -4.516 6.446 1.00 0.00 O HETATM 37 N UNL 1 -7.848 -1.618 4.110 1.00 0.00 N HETATM 38 H UNL 1 -5.435 -5.719 -8.623 1.00 0.00 H HETATM 39 H UNL 1 -7.746 -6.148 -9.488 1.00 0.00 H HETATM 40 H UNL 1 -9.262 -7.592 -8.183 1.00 0.00 H HETATM 41 H UNL 1 -4.482 -7.330 -6.992 1.00 0.00 H HETATM 42 H UNL 1 -6.876 -10.198 -8.040 1.00 0.00 H HETATM 43 H UNL 1 -5.239 -10.249 -7.317 1.00 0.00 H HETATM 44 H UNL 1 -5.581 -9.241 -8.732 1.00 0.00 H HETATM 45 H UNL 1 -6.665 -7.323 -4.337 1.00 0.00 H HETATM 46 H UNL 1 -7.483 -8.827 -3.885 1.00 0.00 H HETATM 47 H UNL 1 -7.697 -6.754 -2.299 1.00 0.00 H HETATM 48 H UNL 1 -9.146 -7.718 -2.631 1.00 0.00 H HETATM 49 H UNL 1 -9.737 -5.281 -5.499 1.00 0.00 H HETATM 50 H UNL 1 -11.045 -5.996 -4.539 1.00 0.00 H HETATM 51 H UNL 1 -10.291 -7.459 -6.397 1.00 0.00 H HETATM 52 H UNL 1 -10.285 -8.220 -4.836 1.00 0.00 H HETATM 53 H UNL 1 -8.119 -3.262 -2.661 1.00 0.00 H HETATM 54 H UNL 1 -7.891 -4.216 -1.165 1.00 0.00 H HETATM 55 H UNL 1 -10.458 -3.711 0.686 1.00 0.00 H HETATM 56 H UNL 1 -10.327 -1.049 2.122 1.00 0.00 H HETATM 57 H UNL 1 -11.642 -1.662 1.215 1.00 0.00 H HETATM 58 H UNL 1 -10.859 -1.222 -0.253 1.00 0.00 H HETATM 59 H UNL 1 -10.169 0.731 -1.720 1.00 0.00 H HETATM 60 H UNL 1 -11.622 -0.134 -1.422 1.00 0.00 H HETATM 61 H UNL 1 -9.277 -1.165 -2.830 1.00 0.00 H HETATM 62 H UNL 1 -10.814 -1.974 -2.560 1.00 0.00 H HETATM 63 H UNL 1 -7.241 -2.899 0.474 1.00 0.00 H HETATM 64 H UNL 1 -6.900 -1.314 1.250 1.00 0.00 H HETATM 65 H UNL 1 -6.336 -1.780 -0.351 1.00 0.00 H HETATM 66 H UNL 1 -8.309 0.734 -1.593 1.00 0.00 H HETATM 67 H UNL 1 -6.813 -0.137 -1.481 1.00 0.00 H HETATM 68 H UNL 1 -7.475 0.706 -0.078 1.00 0.00 H HETATM 69 H UNL 1 -8.990 -2.059 2.560 1.00 0.00 H HETATM 70 H UNL 1 -6.318 -2.929 3.634 1.00 0.00 H HETATM 71 H UNL 1 -7.059 -3.077 6.040 1.00 0.00 H HETATM 72 H UNL 1 -8.609 -3.718 5.526 1.00 0.00 H HETATM 73 H UNL 1 -7.423 -5.773 4.633 1.00 0.00 H HETATM 74 H UNL 1 -7.268 -5.501 6.375 1.00 0.00 H HETATM 75 H UNL 1 -5.431 -7.492 4.725 1.00 0.00 H HETATM 76 H UNL 1 -5.323 -7.239 6.500 1.00 0.00 H HETATM 77 H UNL 1 -3.853 -7.119 5.485 1.00 0.00 H HETATM 78 H UNL 1 -8.795 -1.547 4.470 1.00 0.00 H HETATM 79 H UNL 1 -7.656 -0.997 3.331 1.00 0.00 H CONECT 1 2 6 38 CONECT 2 1 3 39 CONECT 3 2 4 40 CONECT 4 3 5 8 CONECT 5 4 6 7 CONECT 6 5 1 41 CONECT 7 5 42 43 44 CONECT 8 4 9 13 CONECT 9 8 10 45 46 CONECT 10 9 11 47 48 CONECT 11 10 12 14 CONECT 12 11 13 49 50 CONECT 13 12 8 51 52 CONECT 14 11 15 16 17 CONECT 15 14 18 53 54 CONECT 16 14 CONECT 17 14 CONECT 18 15 19 23 24 CONECT 19 18 20 27 55 CONECT 20 19 21 56 57 CONECT 21 20 22 24 58 CONECT 22 21 23 59 60 CONECT 23 22 18 61 62 CONECT 24 18 21 25 26 CONECT 25 24 63 64 65 CONECT 26 24 66 67 68 CONECT 27 19 28 69 CONECT 28 27 30 29 CONECT 29 37 31 28 70 CONECT 30 28 CONECT 31 32 29 71 72 CONECT 32 31 33 73 74 CONECT 33 32 34 35 36 CONECT 34 33 75 76 77 CONECT 35 33 CONECT 36 33 CONECT 37 29 78 79 CONECT 38 1 CONECT 39 2 CONECT 40 3 CONECT 41 6 CONECT 42 7 CONECT 43 7 CONECT 44 7 CONECT 45 9 CONECT 46 9 CONECT 47 10 CONECT 48 10 CONECT 49 12 CONECT 50 12 CONECT 51 13 CONECT 52 13 CONECT 53 15 CONECT 54 15 CONECT 55 19 CONECT 56 20 CONECT 57 20 CONECT 58 21 CONECT 59 22 CONECT 60 22 CONECT 61 23 CONECT 62 23 CONECT 63 25 CONECT 64 25 CONECT 65 25 CONECT 66 26 CONECT 67 26 CONECT 68 26 CONECT 69 27 CONECT 70 29 CONECT 71 31 CONECT 72 31 CONECT 73 32 CONECT 74 32 CONECT 75 34 CONECT 76 34 CONECT 77 34 CONECT 78 37 CONECT 79 37 MASTER 0 0 0 0 0 0 0 0 79 0 79 0 END M END $$$$