RDKit 3D 76 80 0 0 0 0 0 0 0 0999 V2000 3.2648 3.3651 -1.2459 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2101 1.9812 -1.5626 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3437 1.1127 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7435 0.3657 0.1435 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9692 0.3389 0.7052 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1685 0.9338 0.4587 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1685 -0.0090 0.3157 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4298 0.4994 0.1478 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4327 -0.6181 0.1196 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 1.5867 1.1199 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9846 2.2041 0.8392 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7126 2.6304 1.2483 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9663 3.5633 2.2207 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4383 1.8976 1.6015 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5070 1.2193 2.7953 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7912 -0.4794 0.7312 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4942 -0.5930 0.2933 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3392 -1.3962 0.8855 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6284 -1.5400 0.4946 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4392 -2.4776 1.2512 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9829 -2.8694 2.5056 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6599 -3.7822 3.2682 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8256 -4.3571 2.8291 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5219 -5.2957 3.6173 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3212 -4.0029 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4783 -4.5513 1.0972 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5942 -3.0646 0.8407 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9967 -0.7772 -0.5662 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3088 -0.8458 -1.0152 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3382 -0.0306 -0.4683 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4734 -0.7301 -0.2496 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5992 -0.3258 -0.9007 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.5961 -1.5047 -0.8744 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4672 0.0431 -2.3512 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.5459 0.8972 -2.6794 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1696 0.7835 -2.5791 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3048 -0.1417 -3.1822 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6824 1.2112 -1.2295 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8176 2.2543 -1.1797 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1334 0.1010 -1.2461 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5317 0.7759 -2.2403 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1494 0.1836 -0.7865 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0585 1.0287 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6373 1.7804 -2.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0333 3.8888 -2.1981 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4696 3.6359 -0.5449 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2784 3.6913 -0.9557 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2346 1.5537 -0.4549 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4427 0.9844 -0.8641 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9629 -1.6371 0.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1811 -0.5516 0.9567 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0713 -0.6132 -0.8114 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8825 1.1077 2.1207 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8291 3.1450 0.6336 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5321 3.0832 0.2504 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3224 3.4724 2.9793 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5695 2.5874 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2841 1.4430 3.3517 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0735 -1.0980 1.5991 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0664 -2.4458 2.9073 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3068 -4.0930 4.2592 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3274 -5.7540 3.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0114 -5.2647 1.4571 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9739 -2.8531 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9286 0.3387 0.5166 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1463 0.4695 -0.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6071 -1.0995 -0.9241 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4881 -2.0724 0.0634 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3994 -2.1137 -1.7715 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5338 -0.8931 -2.9734 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1953 1.7625 -2.9527 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 1.6749 -3.2159 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5133 -0.0900 -4.1625 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6248 1.6052 -0.7076 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4714 2.3207 -0.2531 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2516 2.4504 -2.9396 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 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 4 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 2 0 19 28 2 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 28 40 1 0 40 41 2 0 40 42 1 0 42 43 2 0 43 44 1 0 43 3 1 0 14 6 1 0 42 17 1 0 27 20 1 0 38 30 1 0 1 45 1 0 1 46 1 0 1 47 1 0 6 48 1 6 8 49 1 6 9 50 1 0 9 51 1 0 9 52 1 0 10 53 1 1 11 54 1 0 12 55 1 6 13 56 1 0 14 57 1 1 15 58 1 0 16 59 1 0 21 60 1 0 22 61 1 0 24 62 1 0 26 63 1 0 27 64 1 0 30 65 1 1 32 66 1 1 33 67 1 0 33 68 1 0 33 69 1 0 34 70 1 6 35 71 1 0 36 72 1 6 37 73 1 0 38 74 1 1 39 75 1 0 44 76 1 0 M END