RDKit 3D 105111 0 0 0 0 0 0 0 0999 V2000 4.8420 5.8197 -7.1526 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8777 5.8490 -6.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8368 6.7246 -5.1539 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0612 4.7613 -6.0546 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0338 4.6884 -5.0280 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8387 3.1889 -4.6859 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1781 2.4953 -4.3438 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9407 1.2734 -3.4439 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2454 0.5118 -3.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3187 1.7658 -2.1159 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3891 2.9863 -2.3512 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8614 2.9847 -3.6618 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3144 2.8314 -1.2658 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6864 3.5329 -1.1821 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6882 1.7310 -0.2819 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5895 2.4287 0.7722 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 0.9769 0.3865 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2024 1.7776 1.4827 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3684 0.9757 2.0559 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8353 -0.2086 2.8726 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9326 -1.0957 3.5589 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8708 -1.7776 2.5391 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8279 -0.2249 4.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -2.1525 4.4609 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1775 -3.0634 5.0037 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0296 -3.2758 6.4133 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7730 -3.8739 6.7214 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -4.1065 8.1228 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -5.0552 8.6590 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5591 -5.2061 10.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0761 -4.5104 8.3256 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0678 -5.4747 8.7128 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1847 -4.2026 6.8352 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4639 -3.6017 6.5751 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1647 -2.9659 3.6934 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1352 -2.0680 3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -1.0621 2.1017 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0722 -1.5205 0.6901 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0438 -0.4218 0.9109 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4375 -0.7979 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 -0.2531 -0.4541 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4365 0.7773 -1.2802 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4786 -0.0041 -2.2333 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7563 5.4485 -5.5202 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3090 5.6017 -4.4314 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1378 4.8142 -6.7697 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1189 6.7906 -5.9095 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4857 6.7027 -7.1067 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2946 5.8369 -8.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4687 4.9269 -7.0861 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3951 5.1900 -4.1203 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4495 2.6788 -5.5749 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6896 2.2088 -5.2709 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8466 3.1969 -3.8264 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2589 0.6127 -3.9868 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0785 -0.3978 -2.6365 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9811 1.1264 -2.6889 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6872 0.2121 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1473 2.1076 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9235 3.9233 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0688 3.2814 1.2249 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5076 2.8456 0.3498 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8836 1.7590 1.5839 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2415 0.8151 -0.3919 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5213 2.0396 2.3003 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5894 2.7159 1.0716 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9533 1.6433 2.6975 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 0.6491 1.2462 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2593 0.2481 3.6937 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3728 -1.0433 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6606 -2.3459 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3422 -2.4775 1.8877 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5327 -0.8375 5.0482 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4278 0.4872 3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2247 0.3432 5.1918 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7013 -1.6140 5.2725 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1237 -2.3034 6.9154 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6227 -4.5388 8.2861 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6255 -3.1494 8.6593 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 -6.0485 8.2102 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3596 -5.6964 10.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2884 -3.6138 8.9215 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9019 -5.1559 8.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1585 -5.1357 6.2584 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4223 -3.3174 5.6391 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6554 -3.6081 2.9519 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6522 -3.6544 4.3751 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4482 -1.5288 3.7743 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5662 -2.7106 2.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7232 -2.5035 0.3867 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0178 -1.2712 0.2195 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9553 -0.4736 1.6745 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5499 -1.8887 0.7421 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1523 0.1753 -0.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5089 -1.0983 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1262 0.6617 -2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2136 -0.6619 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0391 -0.6687 -2.8991 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1321 5.9910 -3.5071 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0723 6.3278 -4.7363 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8203 4.6619 -4.2083 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8732 4.7354 -7.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6762 5.4378 -7.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2681 3.8185 -6.5685 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7398 7.1459 -5.2428 H 0 0 0 0 0 0 0 0 0 0 0 0 37 36 1 1 26 33 1 0 42 15 1 0 33 31 1 0 31 29 1 0 29 28 1 0 15 13 1 0 13 11 1 0 10 42 1 0 28 27 1 0 42 43 1 6 24 25 1 0 10 11 1 0 27 26 1 0 29 30 1 0 8 10 1 0 31 32 1 0 8 9 1 0 33 34 1 0 15 16 1 1 39 38 1 6 21 22 1 6 37 20 1 0 21 23 1 0 39 40 1 0 13 14 2 0 17 15 1 0 11 12 1 0 42 41 1 0 12 6 1 0 41 40 1 0 6 7 1 0 7 8 1 0 35 24 1 0 6 5 1 0 35 36 1 0 6 52 1 6 24 21 1 0 5 44 1 0 37 38 1 0 44 47 1 6 37 39 1 0 44 45 1 0 20 19 1 0 44 46 1 0 19 18 1 0 5 4 1 0 18 17 1 0 4 2 1 0 39 17 1 0 2 1 1 0 21 20 1 0 2 3 2 0 26 25 1 0 30 81 1 0 26 77 1 1 29 80 1 6 31 82 1 1 32 83 1 0 33 84 1 6 34 85 1 0 28 78 1 0 28 79 1 0 35 86 1 0 35 87 1 0 24 76 1 1 36 88 1 0 36 89 1 0 20 69 1 1 19 67 1 0 19 68 1 0 17 64 1 6 41 94 1 0 41 95 1 0 40 92 1 0 40 93 1 0 38 90 1 0 38 91 1 0 18 65 1 0 18 66 1 0 43 96 1 0 43 97 1 0 43 98 1 0 10 59 1 1 11 60 1 1 8 55 1 6 9 56 1 0 9 57 1 0 9 58 1 0 16 61 1 0 16 62 1 0 16 63 1 0 22 70 1 0 22 71 1 0 22 72 1 0 23 73 1 0 23 74 1 0 23 75 1 0 7 53 1 0 7 54 1 0 5 51 1 1 47105 1 0 45 99 1 0 45100 1 0 45101 1 0 46102 1 0 46103 1 0 46104 1 0 1 48 1 0 1 49 1 0 1 50 1 0 M END