RDKit 3D 99105 0 0 0 0 0 0 0 0999 V2000 2.4353 -4.3986 0.8245 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6489 -3.5051 -0.1533 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8082 -2.2285 0.2809 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2067 -1.2273 -0.4851 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7438 -1.2710 -1.8783 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8350 -1.8935 -2.7721 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -0.0310 -2.5180 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3645 -0.2349 -3.2769 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2336 0.1553 -4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5852 1.0920 -1.5389 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5223 1.9412 -2.0638 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2423 1.7951 -1.2735 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6815 1.1817 -0.0435 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5978 0.0515 0.2635 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9794 0.4210 -0.2858 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7848 1.0879 0.6083 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9958 0.6968 1.1163 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3495 -0.4193 0.6648 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7887 1.4586 2.0577 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9952 0.9542 2.4942 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8009 1.6503 3.4005 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3870 2.8791 3.8793 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1732 3.4006 3.4486 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4065 2.6845 2.5542 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7581 0.8062 -0.1674 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5852 1.9531 -0.6378 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4350 1.6020 -1.6754 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3596 2.3389 -2.8136 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3915 2.5733 0.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3167 1.5718 1.1269 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6422 1.6550 0.7738 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7405 1.9652 1.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1324 2.0138 0.9877 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 2.2223 2.7027 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7997 0.1302 1.0361 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2408 -0.5604 2.2977 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5437 -0.6883 2.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4371 -1.3804 1.8322 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2686 -0.5932 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3983 -0.5739 -1.2588 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8738 -1.0107 -2.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1695 -2.4919 -2.5742 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0182 -0.3510 -1.1138 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2751 -1.4595 -0.4112 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8032 -1.2980 1.0029 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1475 -1.6215 1.9536 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1108 -2.7081 2.7362 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 0.1365 1.0997 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3852 -3.8832 1.0705 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8051 -4.6146 1.6875 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7504 -5.3406 0.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0396 -3.7598 -1.1426 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5936 -3.8965 -0.0628 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6273 -1.9805 -1.8782 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2592 -2.5265 -3.3689 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4649 0.4165 -3.2412 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3986 -0.4420 -5.0545 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1004 1.2306 -4.7516 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1425 -0.1503 -5.1494 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1619 2.7005 -2.5745 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 2.9081 -1.1843 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5882 1.7090 -2.1631 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7437 1.9409 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7651 -0.0962 1.3326 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5166 -0.5254 -0.5233 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3058 -0.0181 2.1056 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7363 1.2276 3.7203 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9689 3.4562 4.5778 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8552 4.3620 3.8269 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4728 3.0967 2.2297 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9663 2.7752 -1.0177 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3583 2.2799 -3.2633 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0805 1.9640 -3.5893 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5824 3.4069 -2.5737 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6414 2.9513 1.2278 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8739 3.4659 0.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 1.7873 2.2185 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1575 2.2463 -0.1033 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7363 2.7940 1.4903 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6528 1.0434 1.1081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7879 -1.5918 2.4083 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8236 0.0606 3.1831 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0683 -2.4531 1.7635 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7079 -1.0558 0.8253 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4245 -1.5006 2.4334 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2289 -0.0757 -0.4915 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5984 -1.6415 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1579 -0.7925 -3.3252 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8488 -0.4891 -2.7248 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3975 -2.7007 -3.6608 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3234 -3.0890 -2.2357 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1047 -2.6911 -2.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5954 -0.1684 -2.1184 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5201 -2.4461 -0.8114 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6023 -2.0556 1.0904 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7913 -2.8168 3.4166 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2991 -3.5885 2.1279 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9398 -2.5437 3.4939 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9377 0.6386 2.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 4 3 1 1 4 14 1 0 14 13 1 0 13 12 1 0 12 10 1 0 10 11 1 6 10 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 10 7 1 0 7 8 1 0 8 9 1 0 7 5 1 0 5 6 1 0 13 25 1 0 25 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 45 48 1 0 48 35 1 0 35 36 1 1 36 37 1 0 37 38 1 0 35 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 35 30 1 0 30 29 1 0 29 26 1 0 26 27 1 0 27 28 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 2 0 5 4 1 0 48 25 1 0 44 4 1 0 15 14 1 0 24 19 1 0 25 26 1 6 40 43 1 0 1 49 1 0 1 50 1 0 1 51 1 0 2 52 1 0 2 53 1 0 14 64 1 1 13 63 1 1 12 61 1 0 12 62 1 0 11 60 1 0 15 65 1 6 20 66 1 0 21 67 1 0 22 68 1 0 23 69 1 0 24 70 1 0 7 56 1 6 9 57 1 0 9 58 1 0 9 59 1 0 5 54 1 1 6 55 1 0 43 93 1 6 44 94 1 6 45 95 1 6 47 96 1 0 47 97 1 0 47 98 1 0 48 99 1 1 36 81 1 0 36 82 1 0 38 83 1 0 38 84 1 0 38 85 1 0 39 86 1 0 39 87 1 0 41 88 1 0 41 89 1 0 42 90 1 0 42 91 1 0 42 92 1 0 30 77 1 1 29 75 1 0 29 76 1 0 26 71 1 6 28 72 1 0 28 73 1 0 28 74 1 0 33 78 1 0 33 79 1 0 33 80 1 0 M END