RDKit 3D 101105 0 0 0 0 0 0 0 0999 V2000 -4.4937 2.2321 0.8799 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3427 1.1564 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7891 0.7998 -1.1373 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6248 -0.3833 -1.6188 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3907 0.3053 -0.9531 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7732 -0.0952 -2.2047 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5311 0.8084 -3.2704 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6464 0.3885 -4.4643 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1477 2.2290 -3.0631 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5182 3.2669 -3.8868 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 4.6049 -3.1020 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 3.7580 -1.8035 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4153 2.5162 -2.0378 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1875 4.1296 -0.6146 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6312 5.4504 -0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0678 5.3223 0.4162 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2154 5.6767 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1574 4.2581 -1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0484 3.1711 -1.2019 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8202 3.0655 -2.1804 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0978 2.1421 -0.1463 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1090 2.6455 0.8976 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6289 1.3908 1.3246 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4095 0.4178 0.3617 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6777 0.8897 -0.5997 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8691 -1.0133 0.2790 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0880 -0.9807 -0.6549 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7501 -2.3156 -0.7359 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0615 0.0054 -0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3204 0.1323 -0.8619 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -1.4395 1.6029 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3048 -2.7904 2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3127 -3.1343 2.7534 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2672 -3.8065 1.7008 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5565 -5.1325 1.4652 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9756 -5.7590 1.1513 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0918 -4.3144 1.3409 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0183 -3.4512 1.6255 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3434 -3.8807 1.2672 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5878 -3.4297 -0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2903 -2.2762 -0.5698 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1978 -4.6110 -1.0378 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6527 -2.9601 2.3115 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8437 -2.4085 2.7496 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2303 -2.6495 3.9622 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8152 -1.5392 2.0462 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3126 -0.8820 0.8777 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3292 -0.7874 0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2223 -1.8178 0.2976 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1017 -2.2096 1.6789 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1099 -3.6840 1.8731 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 2.9841 0.0963 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5199 1.8213 1.2502 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0646 2.7282 1.6889 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4392 0.2586 0.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3668 1.5848 0.1496 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8818 1.6737 -1.7764 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3921 -0.6805 -0.9062 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0006 -1.2682 -1.8399 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1138 -0.0910 -2.5729 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7766 1.1605 -0.5423 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4982 -1.0946 -2.3249 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1292 3.2600 -4.8038 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3267 3.3417 0.1289 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4994 6.2850 -0.7439 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6209 6.2799 0.3462 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0657 4.9180 1.4716 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5408 4.5859 -0.2688 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2361 6.4053 1.8994 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3319 4.7062 1.7537 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2261 6.0924 0.9307 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4483 5.2249 -1.4536 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1569 1.9850 0.3904 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8833 3.2766 0.4388 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6132 3.1106 1.7588 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0771 -1.6018 -0.1762 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7612 -0.5947 -1.6394 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4779 -2.4375 0.1048 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3735 -2.3599 -1.6631 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0359 -3.1440 -0.8009 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3865 -0.3625 0.9685 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6031 1.0092 0.0865 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0768 -0.6529 -0.5713 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1444 -0.0284 -1.9404 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8276 1.0995 -0.6744 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5107 -0.7103 2.3364 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5199 -5.6700 1.4711 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9158 -4.8631 1.3463 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6645 -3.2651 -0.3608 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -1.6582 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1437 -2.6211 -1.1514 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2912 -1.5869 -1.2498 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0158 -4.8861 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0253 -5.5231 -0.4567 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6903 -4.3947 -1.6494 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -2.6330 2.8765 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1271 -0.6744 2.7266 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9862 -1.7948 2.2177 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8573 -4.1316 1.1848 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5344 -3.8927 2.9005 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1445 -4.1818 1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 30 29 1 0 29 27 1 0 27 28 1 0 27 26 1 0 26 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 43 1 0 43 44 1 0 44 45 2 0 44 46 1 0 46 47 1 0 47 48 2 0 48 49 1 0 49 50 1 0 50 51 1 0 48 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 14 15 1 0 15 16 1 0 15 17 1 0 5 3 1 0 3 4 1 0 3 2 1 0 2 1 1 0 39 40 1 0 40 41 1 0 40 42 1 0 24 26 1 0 38 34 1 0 50 46 1 0 13 9 1 0 25 21 1 0 30 83 1 0 30 84 1 0 30 85 1 0 29 81 1 0 29 82 1 0 27 77 1 6 28 78 1 0 28 79 1 0 28 80 1 0 26 76 1 6 31 86 1 0 35 87 1 0 39 88 1 1 43 96 1 0 46 97 1 1 50 98 1 1 51 99 1 0 51100 1 0 51101 1 0 5 61 1 1 6 62 1 0 10 63 1 0 14 64 1 1 18 72 1 0 21 73 1 1 22 74 1 0 22 75 1 0 15 65 1 0 16 66 1 0 16 67 1 0 16 68 1 0 17 69 1 0 17 70 1 0 17 71 1 0 3 57 1 6 4 58 1 0 4 59 1 0 4 60 1 0 2 55 1 0 2 56 1 0 1 52 1 0 1 53 1 0 1 54 1 0 40 89 1 0 41 90 1 0 41 91 1 0 41 92 1 0 42 93 1 0 42 94 1 0 42 95 1 0 M END