RDKit 3D 118123 0 0 0 0 0 0 0 0999 V2000 -0.7802 -2.2414 -7.6216 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -2.0712 -6.1614 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2853 -1.5110 -5.5919 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7103 -2.5524 -5.3632 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6457 -2.4070 -3.9753 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0681 -3.3379 -3.1455 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0212 -3.1525 -1.7526 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4238 -4.1482 -1.0259 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -4.4113 -1.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4863 -5.5211 -0.2731 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6472 -3.6749 -1.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5517 -2.0451 -1.2315 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -1.0718 -2.0791 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1929 -1.2637 -3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6812 0.0491 -1.4136 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4455 -0.1091 -0.2358 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3330 1.0736 0.6107 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9683 1.0935 1.9442 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9302 2.2724 2.6852 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2559 3.4811 2.1202 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2207 4.6773 2.8632 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3921 5.0641 3.5384 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5293 6.2730 4.3522 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3875 4.2896 3.4154 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6209 3.4747 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9428 4.7138 0.2602 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0584 5.6333 -0.2287 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5942 6.9126 -0.7571 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8309 5.3541 -0.2091 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6577 2.3132 0.0597 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0642 -1.4284 0.4700 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8319 -2.3690 -0.3103 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9411 -2.9137 0.3135 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -3.9097 -0.3168 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 -2.5435 1.4866 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6275 -1.6380 0.2001 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7534 -2.2633 1.1496 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9579 -3.3880 1.8882 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1314 -4.1097 1.7486 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -4.3919 2.8681 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1652 -5.1733 2.8071 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -3.9332 3.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -3.8856 2.8127 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1658 -3.2275 3.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1151 -3.6711 3.9071 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1581 -4.4509 3.4662 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2068 -4.9517 4.4247 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3148 -4.7961 2.2729 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4249 -2.0792 2.2757 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4984 -1.6122 1.3785 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -0.4651 0.6667 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9739 0.2385 0.9267 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2678 1.2529 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1408 0.9283 -1.4431 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4025 1.8794 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7903 3.1551 -2.0967 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0583 4.1301 -3.0469 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2731 4.3018 -3.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5103 5.3690 -4.6872 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2169 3.5315 -3.3804 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9219 3.4959 -0.7661 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3133 4.7811 -0.4047 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6638 5.0044 -0.2003 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2294 6.3127 0.1861 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 4.0514 -0.3444 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6561 2.5294 0.2131 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0686 -0.7331 1.1746 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3673 -0.2625 1.0892 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3387 -0.7368 0.2412 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6970 -0.1541 0.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0178 -1.6852 -0.5306 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7545 -1.4001 2.5032 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3802 -1.4085 -8.0304 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2141 -2.3366 -8.1122 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3459 -3.1755 -7.8216 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6445 -4.2253 -3.5669 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1003 -6.5127 -0.6408 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1324 -5.4497 0.7634 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5973 -5.5287 -0.2715 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6602 -0.5040 -4.0652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5074 -0.1505 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6992 0.1920 2.4388 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6387 2.2492 3.7314 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5701 6.6468 4.2573 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3537 6.1021 5.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8516 7.0935 4.0472 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8454 7.4701 -1.3374 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4367 6.6678 -1.4348 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9784 7.5563 0.0725 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9482 2.3262 -0.9886 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3444 -1.3593 1.4891 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4397 -3.3700 -1.1006 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1688 -4.6767 -0.7954 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4762 -4.3822 0.4336 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2327 -0.5349 0.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9926 -4.7324 3.4197 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9959 -6.1998 3.2478 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4799 -5.3688 1.7676 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -4.7679 3.3421 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1712 -4.9830 3.9041 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2287 -4.2663 5.2843 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -5.9634 4.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7868 0.7808 1.8994 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8351 -0.0702 -1.7533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 1.6416 -3.4915 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9978 4.9249 -5.5899 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 6.2263 -4.2819 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5468 5.7877 -5.0753 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5914 6.2534 1.2509 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4768 7.1189 0.1516 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1538 6.5518 -0.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7662 2.8240 1.2411 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9725 -1.5673 0.4163 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 -0.7726 0.9062 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1270 -0.2544 -0.7762 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7281 0.9208 0.4867 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5511 -2.1009 2.7648 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -0.6182 3.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 70 69 1 0 69 71 2 0 69 68 1 0 68 67 1 0 67 72 1 0 72 49 1 0 49 44 2 0 44 45 1 0 45 46 1 0 46 47 1 0 46 48 2 0 44 43 1 0 43 38 2 0 38 39 1 0 39 40 1 0 40 41 1 0 40 42 2 0 38 37 1 0 37 36 1 0 36 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 2 0 31 16 1 0 16 15 1 0 15 13 1 0 13 14 2 0 14 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 2 0 7 12 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 2 0 20 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 27 29 2 0 25 30 2 0 37 50 2 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 2 0 54 55 1 0 55 56 2 0 56 57 1 0 57 58 1 0 58 59 1 0 58 60 2 0 56 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 63 65 2 0 61 66 2 0 52 67 1 0 66 53 1 0 50 49 1 0 12 36 1 0 30 17 1 0 12 13 1 0 70114 1 0 70115 1 0 70116 1 0 67113 1 6 72117 1 0 72118 1 0 47100 1 0 47101 1 0 47102 1 0 43 99 1 0 41 96 1 0 41 97 1 0 41 98 1 0 36 95 1 6 31 91 1 1 34 92 1 0 34 93 1 0 34 94 1 0 16 81 1 6 14 80 1 0 1 73 1 0 1 74 1 0 1 75 1 0 6 76 1 0 10 77 1 0 10 78 1 0 10 79 1 0 18 82 1 0 19 83 1 0 23 84 1 0 23 85 1 0 23 86 1 0 28 87 1 0 28 88 1 0 28 89 1 0 30 90 1 0 52103 1 1 54104 1 0 55105 1 0 59106 1 0 59107 1 0 59108 1 0 64109 1 0 64110 1 0 64111 1 0 66112 1 0 M END