RDKit 3D 176185 0 0 0 0 0 0 0 0999 V2000 2.5153 1.6187 -3.2623 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2787 0.7410 -2.2946 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2349 0.6145 -1.1885 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 0.9347 0.0745 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2993 0.0226 0.2952 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8580 -1.0432 1.2415 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2279 -1.4166 2.2532 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0831 -1.6125 0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6039 -2.6081 1.8393 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6614 -2.1686 2.5843 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9295 -2.3978 2.1928 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6234 -1.1593 1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9319 -1.4080 1.3074 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6047 -0.2748 0.8114 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4388 0.1513 1.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7541 0.2392 1.6282 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4475 -1.0447 2.0028 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0557 -2.1559 1.2904 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1958 0.6714 0.2483 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6946 2.0029 0.3494 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0654 2.0408 0.2001 C 0 0 2 0 0 0 0 0 0 0 0 0 13.7068 2.5789 1.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0553 2.2019 1.2045 C 0 0 2 0 0 0 0 0 0 0 0 0 15.8292 2.7442 2.3617 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6623 2.6751 -0.1016 C 0 0 2 0 0 0 0 0 0 0 0 0 16.9103 3.2583 0.0961 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7094 3.6854 -0.7057 C 0 0 2 0 0 0 0 0 0 0 0 0 14.4626 4.6514 0.2574 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3899 2.9537 -0.9537 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4635 2.2944 -2.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2156 0.5491 -0.8452 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5343 1.7512 -1.1154 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1436 -0.4550 -0.5565 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0523 -0.2392 -1.4663 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1852 -3.5123 1.2443 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3573 -3.1375 -0.0806 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1160 -4.5619 1.4337 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3444 -5.7080 0.7087 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8029 -3.9113 1.1288 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7630 -4.8046 1.3784 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3295 0.7909 1.1508 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 0.3278 1.1868 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5709 0.2866 -0.2601 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1280 1.6265 -0.8285 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7325 -0.8622 -0.7445 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3203 -1.9996 -0.9348 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7686 -2.2820 -0.7593 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5321 -1.1896 -0.0621 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0207 0.1265 -0.4934 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6863 1.3187 0.2101 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3264 0.3668 -1.9648 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3257 -0.4679 -2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3784 -1.1715 -1.7680 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.7359 -0.6172 -2.0699 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.7396 0.8209 -2.5231 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4006 -1.3735 -3.2493 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6853 -0.8467 -0.9275 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.9387 -0.2687 -1.2362 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9054 -1.2257 -1.0877 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.4294 -1.6302 -2.3398 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6430 -2.2745 -2.2117 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7643 -3.0864 -0.9556 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.7972 -4.0584 -0.8196 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7384 -2.1180 0.2312 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.0032 -2.7110 1.2285 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0464 -0.8427 -0.1770 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.6569 -0.1466 0.9577 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2891 1.1023 0.9967 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.3322 2.0814 1.0942 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8741 3.3583 0.8442 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.9933 4.3620 1.5542 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4965 5.6526 1.3362 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3001 3.4767 1.2890 C 0 0 2 0 0 0 0 0 0 0 0 0 -12.5825 4.7852 1.6491 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6132 2.5937 2.4876 C 0 0 2 0 0 0 0 0 0 0 0 0 -11.9227 3.0115 3.6099 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2288 1.1445 2.1745 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.3974 0.4154 1.9211 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0931 -0.1810 0.2747 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8294 -0.8644 0.7109 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0136 -1.4553 -0.3741 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1102 -2.9873 -0.1369 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7504 -0.6192 -0.9281 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0880 -0.1166 -2.2746 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3902 2.2532 -3.2751 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8106 1.7127 -4.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -0.3294 -1.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9971 1.4192 -1.2817 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1171 1.9953 -0.0117 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1671 0.8678 0.9251 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -2.8011 2.6172 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5224 -2.6262 3.1349 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5981 -0.3941 2.4412 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0168 -0.7275 0.7979 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7746 0.5079 0.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1415 1.0120 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5719 -0.9147 1.9801 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2681 -1.3020 3.0902 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8221 -2.7753 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0938 0.0797 0.0418 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5429 1.0744 0.0153 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0662 1.0914 1.2076 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2991 3.5340 2.9363 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0904 1.9346 3.0779 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7786 3.2175 2.0154 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7351 1.8404 -0.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5304 2.8723 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0327 4.0862 -1.6674 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5837 5.5771 -0.0576 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6331 3.7609 -1.0702 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7597 1.3528 -2.0925 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7948 0.2582 -1.7774 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5367 2.3820 -0.3766 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5695 -1.4638 -0.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4531 0.4362 -1.0311 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1509 -4.0288 1.5255 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3282 -2.9958 -0.3071 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1812 -4.8631 2.5216 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5333 -5.5166 -0.2663 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7839 -3.7253 0.0232 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1035 -5.7421 1.4604 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4177 1.8969 0.9326 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6664 0.7601 2.2329 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1137 -0.6864 1.6285 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6441 0.9966 1.8352 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2718 2.4373 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6445 1.9008 -1.7587 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0596 1.7046 -1.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7073 -2.8486 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1562 -2.6091 -1.7232 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7806 -3.2206 -0.1196 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -1.3033 1.0278 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5164 1.3803 1.2672 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1931 2.2360 -0.2454 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7286 1.4765 -0.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3509 0.2099 -2.5237 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5475 1.4594 -2.1678 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9295 0.1980 -3.3209 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8571 -1.1668 -3.3754 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4341 -2.1865 -2.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6963 1.2619 -2.1079 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9477 1.4452 -2.1261 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8227 0.8836 -3.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8372 -2.3308 -2.9038 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6362 -1.6170 -4.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2057 -0.7716 -3.6905 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7956 -1.9094 -0.7167 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4519 -2.1755 -0.6825 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5147 -1.5775 -2.2755 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6874 -3.0128 -3.0649 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7604 -3.6100 -0.9827 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3263 -4.2648 -1.6586 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7676 -1.9427 0.5782 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5804 -2.8794 2.0129 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7923 -0.2237 -0.7611 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9483 1.2160 0.0826 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7959 3.5479 -0.2494 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0178 4.1256 2.6463 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9508 4.2830 1.2026 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5644 5.7839 0.3544 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9766 3.1550 0.4675 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0673 5.2146 0.9137 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6959 2.6684 2.6825 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2525 2.5298 4.4031 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7805 0.7172 3.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6532 0.4277 0.9582 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9582 0.9040 0.1456 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8932 -0.2535 1.0754 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2902 -0.1872 1.4036 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2046 -1.6421 1.4619 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5623 -3.2567 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1509 -3.3035 0.0628 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7915 -3.5536 -1.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2321 -1.6607 -0.9146 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3739 -1.0105 -2.9388 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2354 0.3102 -2.8512 H 0 0 0 0 0 0 0 0 0 0 0 0 24 23 1 0 23 22 1 0 22 21 1 0 21 20 1 0 20 19 1 0 19 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 33 14 1 0 14 13 1 0 13 12 1 0 12 11 1 0 11 10 1 0 10 9 1 0 9 8 1 0 8 6 1 0 6 7 2 0 5 6 1 1 5 4 1 0 4 3 1 0 3 2 1 0 2 1 2 3 2 84 1 0 84 83 1 0 83 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 48 81 1 0 81 82 1 6 81 80 1 0 80 79 1 0 79 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 62 63 1 0 62 64 1 0 64 65 1 0 64 66 1 0 66 67 1 0 67 68 1 0 68 69 1 0 69 70 1 0 70 71 1 0 71 72 1 0 70 73 1 0 73 74 1 0 73 75 1 0 75 76 1 0 75 77 1 0 77 78 1 0 57 54 1 0 54 55 1 6 54 56 1 0 54 53 1 0 53 52 1 0 52 51 1 0 51 49 1 0 49 50 1 1 49 43 1 0 43 44 1 6 43 42 1 0 42 41 1 0 9 39 1 0 39 40 1 0 39 37 1 0 37 38 1 0 37 35 1 0 35 36 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 21 29 1 0 29 30 1 0 29 27 1 0 27 28 1 0 27 25 1 0 25 26 1 0 25 23 1 0 16 19 1 0 35 11 1 0 83 5 1 0 43 45 1 0 41 5 1 0 49 48 1 0 53 81 1 0 66 59 1 0 77 68 1 0 24103 1 0 24104 1 0 24105 1 0 23102 1 6 21101 1 6 19100 1 6 31112 1 6 32113 1 0 33114 1 1 34115 1 0 14 95 1 6 12 93 1 0 12 94 1 0 11 92 1 1 9 91 1 1 4 89 1 0 4 90 1 0 3 87 1 0 3 88 1 0 1 85 1 0 1 86 1 0 84175 1 0 84176 1 0 83174 1 6 46129 1 0 47130 1 0 47131 1 0 48132 1 1 82171 1 0 82172 1 0 82173 1 0 80169 1 0 80170 1 0 79167 1 0 79168 1 0 57147 1 1 59148 1 1 61149 1 0 61150 1 0 62151 1 6 63152 1 0 64153 1 1 65154 1 0 66155 1 6 68156 1 6 70157 1 6 71158 1 0 71159 1 0 72160 1 0 73161 1 6 74162 1 0 75163 1 1 76164 1 0 77165 1 1 78166 1 0 55141 1 0 55142 1 0 55143 1 0 56144 1 0 56145 1 0 56146 1 0 53140 1 6 52138 1 0 52139 1 0 51136 1 0 51137 1 0 50133 1 0 50134 1 0 50135 1 0 44126 1 0 44127 1 0 44128 1 0 42124 1 0 42125 1 0 41122 1 0 41123 1 0 39120 1 6 40121 1 0 37118 1 1 38119 1 0 35116 1 1 36117 1 0 16 96 1 1 17 97 1 0 17 98 1 0 18 99 1 0 29110 1 6 30111 1 0 27108 1 6 28109 1 0 25106 1 6 26107 1 0 M END