RDKit 3D 103109 0 0 0 0 0 0 0 0999 V2000 -5.5966 3.4747 4.3663 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5253 3.6400 2.9634 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4336 3.2487 2.2219 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4725 2.7253 2.8403 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3342 3.4091 0.7598 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9962 2.8644 0.2350 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9100 1.4394 0.5673 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8174 0.4494 -0.5565 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2467 -0.3814 -0.7092 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7374 -1.4527 0.5903 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5247 -2.7081 0.8021 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3512 -3.7656 -0.2350 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3937 -5.1666 0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3883 -5.4841 1.3327 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7498 -5.8787 0.9892 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6215 -5.3724 2.6932 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3471 -5.6779 3.6749 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3942 -3.5522 -1.1784 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7582 -2.9206 -0.8179 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3772 -2.3886 -2.1222 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6942 -1.9181 0.2526 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1431 -2.5285 1.4493 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4872 -0.7040 0.0685 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -0.3639 -0.9155 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4844 0.2472 1.2013 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5105 1.1912 1.3528 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5075 1.2043 0.4278 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6322 2.0336 0.3500 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7486 1.1975 0.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9416 1.8597 0.2646 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0523 0.9048 0.4011 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2294 1.3193 0.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8132 -0.4344 0.6343 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0021 2.3914 -1.1733 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2496 2.8567 -1.5059 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9132 3.4318 -1.2855 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8159 3.9666 -2.5566 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5977 2.6908 -1.0178 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5874 3.6158 -1.1294 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5113 2.0787 2.4042 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4559 1.9980 3.3036 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4397 1.0793 3.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4578 0.1875 2.0977 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5973 -0.7853 1.9355 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3558 -1.0508 2.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 -0.5761 -0.5015 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6211 -0.7710 0.5033 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0745 -1.3966 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8314 -2.5493 -1.5951 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0062 -3.3244 -2.7297 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4674 -3.0061 -3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6979 -1.8365 -4.0432 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1463 -1.4919 -5.2494 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -1.0588 -2.9256 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7207 0.1850 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 0.3359 -3.8065 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 1.1574 -1.9102 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4125 1.4501 -1.9677 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2923 2.4306 -1.9408 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8141 2.2805 -1.7078 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8968 3.2786 -1.0502 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3047 2.6477 4.5749 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6227 3.1986 4.8059 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9659 4.4100 4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1813 2.8513 0.2946 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4689 4.4623 0.5103 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2332 3.4679 0.8178 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7882 1.1025 1.1992 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0417 1.2693 1.2341 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1423 -3.1227 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5845 -2.4749 1.0237 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3273 -3.7259 -0.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -5.8565 -0.5541 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4344 -5.3097 0.7548 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5087 -6.7951 3.6317 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0859 -5.4572 4.6553 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2874 -5.1274 3.5559 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4888 -3.7442 -0.5407 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -3.2066 -2.8721 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8814 -1.4986 -2.4975 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4805 -2.3565 -2.0654 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -3.0407 1.2727 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7077 2.7609 1.1609 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0463 2.7202 0.9633 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2175 -1.0208 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 1.5771 -1.8738 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6964 3.3642 -0.7783 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0278 4.2568 -0.5659 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6988 3.9225 -2.9971 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4628 1.8965 -1.7626 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4702 4.1896 -0.3391 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2817 2.8190 2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4516 2.6820 4.1192 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3882 0.9866 3.8423 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2555 -2.8005 -0.6447 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6069 -4.2295 -2.6334 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5868 -3.5847 -4.8278 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6029 -0.7282 -5.5164 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6266 1.5908 -2.9261 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4123 2.8777 -2.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5345 2.0659 -0.6756 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3909 1.5935 -2.4609 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 3.2877 -1.9439 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 6 10 9 1 6 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 12 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 1 21 23 1 0 23 24 2 0 23 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 30 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 26 40 1 0 40 41 2 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 2 0 8 46 1 0 46 47 2 0 46 48 1 0 48 49 2 0 49 50 1 0 50 51 2 0 51 52 1 0 52 53 1 0 52 54 2 0 54 55 1 0 55 56 2 0 55 57 1 0 57 58 1 6 57 59 1 0 59 60 1 0 59 61 1 0 61 6 1 0 57 8 1 0 21 10 1 0 43 25 1 0 54 48 1 0 44 10 1 0 38 28 1 0 1 62 1 0 1 63 1 0 1 64 1 0 5 65 1 0 5 66 1 0 6 67 1 1 7 68 1 0 7 69 1 0 11 70 1 0 11 71 1 0 12 72 1 6 13 73 1 0 13 74 1 0 17 75 1 0 17 76 1 0 17 77 1 0 19 78 1 1 20 79 1 0 20 80 1 0 20 81 1 0 22 82 1 0 28 83 1 1 30 84 1 1 33 85 1 0 34 86 1 6 35 87 1 0 36 88 1 1 37 89 1 0 38 90 1 6 39 91 1 0 40 92 1 0 41 93 1 0 42 94 1 0 49 95 1 0 50 96 1 0 51 97 1 0 53 98 1 0 58 99 1 0 59100 1 6 60101 1 0 60102 1 0 60103 1 0 M END