RDKit 3D 88 92 0 0 0 0 0 0 0 0999 V2000 8.9805 2.7417 -3.9152 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5234 1.9612 -2.7261 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6345 2.4337 -1.5682 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9632 0.6946 -2.8545 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5409 -0.0270 -1.7566 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2505 0.1112 -1.3103 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7670 -0.6017 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3915 -0.4026 0.2163 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8627 -1.0240 1.2386 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4632 -0.8277 1.6636 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0001 -1.5268 2.7462 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6916 -1.3989 3.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1843 -0.5378 2.5604 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 0.1754 1.4639 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5844 0.0169 1.0377 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6235 1.0194 0.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7682 1.4588 1.5674 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6254 2.3009 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1563 3.4669 1.2517 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9693 4.2987 0.5125 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4636 5.4536 1.0996 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 5.5086 1.7931 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1944 6.7424 2.4219 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3414 4.4587 1.8965 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2679 3.9653 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7535 2.7983 -1.3345 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0536 2.4564 -2.6439 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1434 1.6681 -2.9784 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4935 1.2850 -4.3693 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8817 1.2511 -2.0517 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 1.9887 -0.5662 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4773 0.3411 2.2697 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3303 -0.4972 1.4416 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6866 -0.2952 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4925 -1.0890 0.6286 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9312 -2.0852 -0.1198 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7587 -2.8977 -0.9201 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3091 -4.0662 -0.4097 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1862 -4.9605 -1.2036 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0337 -4.3518 0.7807 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5756 -2.3249 -0.1198 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0915 -3.3530 -0.9063 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6881 -3.1835 -2.2229 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1821 -4.3432 -2.9896 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7783 -2.0231 -2.7014 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7982 -1.5073 0.6773 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4874 -0.3962 3.0021 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6653 -1.4426 0.4195 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9592 -1.6061 0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7785 -2.4792 0.6938 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5370 -2.0288 1.7634 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4348 -2.9044 2.5486 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4495 -0.8252 2.0688 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3880 -0.8851 -1.0974 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 2.0842 -4.7947 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2543 3.5373 -4.1831 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9857 3.1567 -3.6499 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5548 0.7793 -1.8071 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7796 0.2854 -0.3434 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4946 -1.7153 1.7943 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -2.2106 3.2885 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -1.9733 4.0674 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8881 0.5905 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3348 2.1005 2.3946 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9332 3.7510 2.2726 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3962 6.5577 3.4859 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1629 6.9641 1.9212 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5129 7.6041 2.2956 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9102 4.6113 -1.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9722 1.9904 -5.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2689 0.2318 -4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5946 1.4214 -4.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5666 1.0853 -1.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0793 0.8392 3.0909 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1409 0.4900 1.9978 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5659 -0.9711 0.5688 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2613 -4.7985 -0.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9879 -6.0432 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0171 -4.8511 -2.2981 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1385 -4.6094 -2.7022 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7973 -5.2282 -2.7323 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -4.2005 -4.0778 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7372 -1.7266 0.6518 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3418 -2.0074 1.2756 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2386 -2.2836 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8732 -3.6573 1.8466 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8893 -3.5029 3.3123 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3966 -1.0060 -1.4303 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 47 1 0 47 32 1 0 32 17 1 0 17 16 1 0 16 14 1 0 14 15 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 2 0 20 25 2 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 28 30 2 0 26 31 2 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 1 0 38 39 1 0 38 40 2 0 36 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 43 45 2 0 41 46 2 0 7 48 2 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 51 53 2 0 49 54 2 0 54 5 1 0 15 10 1 0 31 18 1 0 46 33 1 0 14 13 1 0 1 55 1 0 1 56 1 0 1 57 1 0 6 58 1 0 8 59 1 0 9 60 1 0 11 61 1 0 12 62 1 0 32 74 1 1 17 64 1 1 15 63 1 0 19 65 1 0 23 66 1 0 23 67 1 0 23 68 1 0 25 69 1 0 29 70 1 0 29 71 1 0 29 72 1 0 31 73 1 0 34 75 1 0 35 76 1 0 39 77 1 0 39 78 1 0 39 79 1 0 44 80 1 0 44 81 1 0 44 82 1 0 46 83 1 0 48 84 1 0 52 85 1 0 52 86 1 0 52 87 1 0 54 88 1 0 M END