RDKit 3D 114121 0 0 0 0 0 0 0 0999 V2000 -5.9476 -0.5093 0.8789 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5930 -0.8929 -0.4485 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8911 -0.1921 -1.4831 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3297 -0.5349 -2.8040 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2073 -1.9265 -3.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9947 -2.3083 -3.7688 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7139 -2.1821 -2.9022 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4313 -0.8015 -2.6727 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2406 -0.5570 -1.9183 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0082 -0.6256 -2.8236 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2634 -0.2161 -2.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1965 1.1905 -1.4140 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1422 2.2766 -2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1051 1.2878 -0.6088 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1481 1.7175 0.6644 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0456 2.1346 1.4605 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3093 1.0576 2.3498 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2746 2.4659 0.5819 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4838 1.3664 -0.4939 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7724 1.6033 -1.3114 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0008 1.8620 -0.4455 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8101 3.0359 0.5494 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7311 4.3623 -0.2216 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5475 2.7919 1.4122 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0150 1.7270 2.4214 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5009 1.9956 2.6528 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7029 2.5800 3.9442 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6281 3.6617 3.7858 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4604 4.6591 4.9366 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9076 4.0513 6.2645 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3159 3.4663 6.1331 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7415 2.7612 7.4163 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3763 2.5178 4.9352 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9722 3.1743 3.7343 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2398 4.2628 2.4261 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3062 5.1708 1.8194 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9623 3.0046 1.5911 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3748 0.8415 -1.3031 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -2.9071 -1.6728 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4957 -4.1812 -1.7844 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8898 -5.1266 -0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6479 -5.6628 -1.1962 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4299 -4.7412 -3.2125 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9936 -6.0501 -3.3306 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1795 -3.7885 -4.1617 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7021 -4.0121 -5.4981 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8050 -0.1072 -2.9494 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.9541 1.3222 -2.8078 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6610 -0.7825 -1.8731 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.0036 -0.2633 -1.9033 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0855 -0.5399 -0.4721 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.8184 -1.3159 0.4808 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8805 -0.7576 0.8669 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4146 -1.0297 1.7203 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0160 0.5706 1.0501 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4579 -1.9734 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7370 0.0611 -3.5079 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9086 -1.6863 -4.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8709 -2.5973 -3.4666 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1453 -1.2836 -1.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1572 0.0024 -3.7105 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8796 -1.6439 -3.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1037 -0.2662 -2.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4598 -0.9753 -1.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7935 2.2563 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9395 2.1418 -3.2576 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2342 3.2838 -2.0988 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1019 1.7526 1.1862 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2061 3.0149 2.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 0.8370 2.8028 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0255 3.3912 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6299 0.4207 0.0484 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 2.4524 -1.9902 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9753 0.7315 -1.9437 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2496 0.9336 0.0835 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8596 2.0679 -1.0976 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5637 5.2139 0.4449 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9089 4.3758 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6558 4.5429 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3282 3.7031 1.9876 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4498 1.7864 3.3571 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8926 0.7195 2.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0755 1.0637 2.6079 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 5.5531 4.7506 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4143 4.9741 5.0265 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8857 4.8187 7.0471 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2001 3.2686 6.5662 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 4.2990 5.9459 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0797 1.9194 7.6469 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7620 2.3744 7.3264 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7181 3.4526 8.2652 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4055 2.1744 4.7838 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7615 1.6235 5.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3119 4.8347 2.5497 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5368 6.0047 2.4896 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2379 4.6306 1.6218 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9707 5.6002 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8934 2.6567 1.1247 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6516 1.5679 -2.0773 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2269 0.8367 -0.6108 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5417 -4.0243 -1.4937 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7085 -4.5936 0.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5603 -5.9699 -0.5465 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1751 -5.9850 -0.4077 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3882 -4.8222 -3.5496 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3542 -6.6563 -2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2470 -4.0431 -4.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8683 -4.9582 -5.6782 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1934 -0.3707 -3.9391 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2116 1.6286 -2.2491 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7394 -1.8598 -2.0602 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9165 0.6655 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2293 0.5133 -0.1996 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7600 -1.1892 0.2465 H 0 0 0 0 0 0 0 0 0 0 0 0 6 5 1 0 6 7 1 0 6 45 1 0 43 45 1 0 43 40 1 0 16 18 1 0 19 18 1 0 38 14 1 0 12 11 1 0 12 14 1 0 19 20 1 0 18 24 1 0 49 51 1 0 49 47 1 0 47 4 1 0 4 3 1 0 3 2 1 0 2 51 1 0 4 5 1 0 47 48 1 0 49 50 1 0 22 21 1 0 16 17 1 0 37 26 1 0 21 20 1 0 10 9 1 0 10 11 1 0 12 13 1 6 9 38 1 0 26 27 1 0 28 35 1 0 35 37 1 0 12 19 1 0 35 36 1 0 9 8 1 0 28 34 1 6 14 15 2 0 28 29 1 0 15 16 1 0 29 30 1 0 22 24 1 0 34 33 1 0 33 31 1 0 31 30 1 0 43 44 1 0 31 32 1 0 24 25 1 0 40 39 1 0 39 7 1 0 25 26 1 0 40 41 1 0 37 22 1 0 41 42 1 0 45 46 1 0 22 23 1 6 7 8 1 0 51 52 1 0 2 1 1 0 28 27 1 0 7 59 1 6 43105 1 6 44106 1 0 45107 1 6 46108 1 0 6 58 1 6 40101 1 1 10 61 1 0 10 62 1 0 9 60 1 1 38 99 1 0 38100 1 0 11 63 1 0 11 64 1 0 15 68 1 0 16 69 1 1 19 72 1 1 18 71 1 6 21 75 1 0 21 76 1 0 20 73 1 0 20 74 1 0 13 65 1 0 13 66 1 0 13 67 1 0 24 80 1 1 25 81 1 0 25 82 1 0 52114 1 0 51113 1 1 4 57 1 6 1 53 1 0 1 54 1 0 1 55 1 0 2 56 1 6 47109 1 6 48110 1 0 49111 1 6 50112 1 0 17 70 1 0 37 98 1 6 26 83 1 1 35 94 1 1 36 95 1 0 36 96 1 0 36 97 1 0 29 84 1 0 29 85 1 0 30 86 1 0 30 87 1 0 33 92 1 0 33 93 1 0 31 88 1 6 32 89 1 0 32 90 1 0 32 91 1 0 41102 1 0 41103 1 0 42104 1 0 23 77 1 0 23 78 1 0 23 79 1 0 M ISO 1 13 19 M END