RDKit 3D 122127 0 0 0 0 0 0 0 0999 V2000 -8.3816 -4.2819 -1.8909 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5442 -3.5182 -1.0711 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5768 -2.6334 -1.5225 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4259 -2.4931 -2.7619 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7746 -1.9025 -0.5103 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8757 -1.0787 -1.1867 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5237 0.0305 -0.3927 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2900 0.4398 -0.8737 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3116 0.2963 0.1053 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4175 -0.8586 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4879 -0.4553 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4319 0.6920 -1.0035 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3597 1.6654 -2.1899 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0608 1.4295 0.1979 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4331 0.9406 1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6237 0.0270 1.4689 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 0.4425 0.3709 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9482 1.8759 0.5749 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8347 0.2123 -0.9318 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7276 0.7400 -2.0316 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1601 0.5358 -1.7442 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7001 0.0299 -0.6531 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2075 -0.0834 -0.5860 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6950 -1.1240 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4335 -2.2854 -1.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6070 -2.6335 -1.9393 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5875 -3.5432 -0.9886 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0229 -2.1157 0.3645 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0849 -0.7074 0.8304 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7033 -0.0946 0.7936 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9286 1.3273 1.2538 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7467 2.2414 0.4245 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3256 1.5932 2.5576 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5193 2.9472 2.9203 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8457 -0.7068 1.8517 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4268 -0.2501 1.8163 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8002 -0.4046 0.4435 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5180 -1.8853 0.2964 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5661 1.5651 0.2859 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0781 2.6903 -0.6038 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8711 2.0366 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6303 1.0116 -0.5189 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.5301 2.1509 0.2986 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 3.4480 -0.1999 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5036 4.6079 0.6934 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7864 3.6014 -1.4318 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9393 0.2732 -0.2309 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.7509 0.1508 -1.3799 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0127 0.6842 -1.4866 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7769 0.4970 -2.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4732 1.3177 -0.5075 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7311 -1.0923 0.3399 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.3316 -1.0410 1.7039 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0741 -1.5706 2.7346 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5616 -1.4591 4.1118 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1698 -2.1355 2.4767 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3308 -3.7334 -2.0563 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9025 -4.5603 -2.8567 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6523 -5.2124 -1.3133 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2459 -2.6242 0.1145 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3916 -0.2721 0.6616 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7894 -0.0924 1.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -1.6133 -0.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9876 -1.3499 0.5503 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0733 -0.2624 -2.3123 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1446 -1.3590 -1.6487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8692 1.2241 -3.0976 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7091 1.7050 -2.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7663 2.6521 -1.9529 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 2.4957 0.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7094 1.7858 2.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3535 0.3843 2.0998 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0985 0.0554 2.4836 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2316 -1.0043 1.3615 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0479 1.9989 0.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5514 2.2785 1.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6658 2.5235 -0.3047 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8479 -0.9097 -1.0842 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5614 0.1327 -2.9744 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6025 1.8254 -2.2191 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 0.8478 -2.5477 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5664 0.9048 -1.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 -0.6795 -2.3876 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7874 -1.5345 -2.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3379 -1.8016 -1.8965 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0196 -3.5948 -1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1496 -2.7277 -2.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9318 -4.3228 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4691 -3.9575 0.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5598 -3.2522 -1.3495 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5002 -2.7233 1.1332 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0855 -2.5082 0.4158 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7762 -0.1027 0.2169 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4397 -0.7011 1.8786 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6799 3.2874 3.5648 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5452 3.6253 2.0507 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4771 3.0594 3.4626 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -0.3420 2.8426 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8922 -1.7981 1.9384 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8617 -0.9528 2.4996 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2719 0.7491 2.2479 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4811 -2.3911 0.6123 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -2.2121 -0.7361 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7904 -2.2279 1.0291 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2646 3.3677 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7554 3.3911 -0.0258 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7261 2.3178 -1.4233 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0966 2.6805 2.1302 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7983 2.6905 1.6993 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1803 1.1959 2.3741 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7587 1.3891 -1.5667 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 4.2865 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3136 5.3420 0.5201 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 5.1157 0.5405 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5099 0.8648 0.5376 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9308 -0.5661 -2.9753 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7670 0.9801 -2.7107 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1842 0.9331 -3.5599 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7047 -1.6223 0.3318 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3457 -1.8302 4.8035 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6192 -2.0134 4.2744 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3888 -0.3816 4.3684 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 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 6 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 1 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 25 28 1 0 28 29 1 0 29 30 1 0 30 35 1 0 35 36 1 0 36 37 1 0 37 38 1 6 30 31 1 1 31 32 2 0 31 33 1 0 33 34 1 0 14 39 1 0 39 40 1 0 39 41 1 0 7 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 2 0 42 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 49 51 2 0 47 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 54 56 2 0 52 5 1 0 39 9 1 0 19 12 1 0 37 22 1 0 37 17 1 0 30 23 1 0 1 57 1 0 1 58 1 0 1 59 1 0 5 60 1 1 7 61 1 1 9 62 1 1 10 63 1 0 10 64 1 0 11 65 1 0 11 66 1 0 13 67 1 0 13 68 1 0 13 69 1 0 14 70 1 6 15 71 1 0 15 72 1 0 16 73 1 0 16 74 1 0 18 75 1 0 18 76 1 0 18 77 1 0 19 78 1 6 20 79 1 0 20 80 1 0 21 81 1 0 23 82 1 6 24 83 1 0 24 84 1 0 26 85 1 0 26 86 1 0 26 87 1 0 27 88 1 0 27 89 1 0 27 90 1 0 28 91 1 0 28 92 1 0 29 93 1 0 29 94 1 0 35 98 1 0 35 99 1 0 36100 1 0 36101 1 0 38102 1 0 38103 1 0 38104 1 0 34 95 1 0 34 96 1 0 34 97 1 0 40105 1 0 40106 1 0 40107 1 0 41108 1 0 41109 1 0 41110 1 0 42111 1 6 45112 1 0 45113 1 0 45114 1 0 47115 1 1 50116 1 0 50117 1 0 50118 1 0 52119 1 1 55120 1 0 55121 1 0 55122 1 0 M END