RDKit 3D 86 90 0 0 0 0 0 0 0 0999 V2000 -2.1970 8.9957 1.6519 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0973 8.3419 1.0793 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2906 7.1071 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5112 6.4824 0.4227 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 5.2308 -0.1903 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5804 4.6266 -0.7294 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5534 3.3204 -1.4042 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7621 2.4955 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6267 1.0973 -0.8294 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5226 0.3196 -1.5794 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3032 0.4820 -1.0058 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1759 1.2856 -1.0592 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0942 0.7838 -1.2545 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2572 1.7134 -1.3027 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2951 -0.5960 -1.4089 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5739 -1.0379 -1.5781 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5332 -1.1894 -0.5634 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6394 -0.4285 -1.0156 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3169 0.0559 0.0753 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6857 0.6143 -0.3041 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 1.0727 0.8979 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4795 -0.9836 1.1659 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6640 -0.7187 2.2628 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3054 -2.3813 0.6132 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3766 -2.6994 -0.2173 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0166 -2.5245 -0.1973 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1523 -3.2274 0.6652 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1827 -1.3670 -1.3573 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2639 -2.8569 -1.5677 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5422 -3.2694 -1.8632 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1268 -0.8668 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1679 -1.7311 -1.1146 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7088 -2.5055 -0.0983 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5427 -3.8282 -0.5404 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1916 -4.7849 0.1582 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4610 -6.0996 0.1696 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1639 -7.0537 0.9096 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -4.3345 1.5169 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6576 -3.9812 2.3662 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6936 -3.2566 1.2567 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7970 -3.8912 0.6714 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -2.2249 0.3346 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1861 -1.0148 1.0572 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3987 2.6529 -0.9009 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3392 5.2780 -0.6579 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 6.4943 -0.0651 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8613 10.0087 1.9598 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9921 9.0957 0.9146 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5607 8.4297 2.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3677 6.9575 0.8497 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6449 4.8103 -0.1998 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2541 3.5667 -2.4775 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1676 2.4484 -2.4466 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5796 2.9990 -0.8336 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8798 1.1536 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3015 0.5084 -2.5397 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9843 1.4684 -2.0906 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7072 1.8754 -0.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8537 2.7329 -1.5876 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1542 -0.6823 0.3476 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7456 0.9057 0.4978 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5781 1.4695 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3718 -0.1816 -0.6659 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1610 0.7123 1.0592 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5285 -0.9317 1.5223 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9582 0.1629 2.6089 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3365 -3.0626 1.4893 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0849 -3.5288 -0.7051 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1714 -3.1915 -1.0787 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7367 -2.6090 1.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0311 -3.3327 -0.5597 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4907 -3.2196 -2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5202 -4.0164 -2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0579 -2.3847 0.8011 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1517 -4.9976 -0.4171 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5273 -6.4790 -0.8987 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4203 -5.9939 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1146 -6.9532 0.6262 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1703 -5.2464 1.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1631 -4.7854 2.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0274 -2.8490 2.2368 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 -3.3070 0.0754 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8125 -2.0939 -0.5096 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4127 -0.8540 1.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5554 4.8263 -1.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 6.9718 -0.0288 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 45 1 0 45 46 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 31 2 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 35 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 31 28 1 0 28 29 1 0 29 30 1 0 28 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 19 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 15 13 1 0 13 14 1 0 13 12 2 0 12 44 1 0 46 3 1 0 44 7 1 0 12 11 1 0 42 33 1 0 26 17 1 0 1 47 1 0 1 48 1 0 1 49 1 0 4 50 1 0 5 51 1 0 45 85 1 0 46 86 1 0 7 52 1 6 8 53 1 0 8 54 1 0 9 55 1 1 10 56 1 0 33 74 1 1 35 75 1 6 36 76 1 0 36 77 1 0 37 78 1 0 38 79 1 1 39 80 1 0 40 81 1 1 41 82 1 0 42 83 1 6 43 84 1 0 29 71 1 0 29 72 1 0 30 73 1 0 17 60 1 1 19 61 1 1 20 62 1 0 20 63 1 0 21 64 1 0 22 65 1 1 23 66 1 0 24 67 1 1 25 68 1 0 26 69 1 6 27 70 1 0 14 57 1 0 14 58 1 0 14 59 1 0 M END