RDKit 3D 98104 0 0 0 0 0 0 0 0999 V2000 -1.1492 5.8133 -3.5861 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1757 4.4159 -4.1490 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 3.3575 -2.7578 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1817 3.6372 -1.6161 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3729 2.2277 -3.0154 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7059 1.3637 -1.9366 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4733 0.7164 -1.3757 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2388 0.8986 -1.8098 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2768 0.0957 -1.0133 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7772 0.9311 -0.5911 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0663 -0.2128 0.2483 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5725 -1.4725 0.8653 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -1.5522 1.6746 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9812 -2.6914 2.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4545 -0.4952 2.0212 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5937 -0.7104 2.8105 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8528 -0.1406 2.2211 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3708 -1.0055 1.2857 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4744 -0.4749 0.0241 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3082 -0.9764 -0.7675 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2472 -0.4730 -2.0979 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -0.3114 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8501 0.2545 -4.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1915 0.2769 -5.0793 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1792 0.7437 -3.7406 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 0.7807 -2.3327 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2514 0.7972 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9778 -0.0689 -0.4473 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9700 -0.2873 0.6746 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4285 0.0537 1.8712 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7021 -0.7643 -0.6725 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6510 -0.6627 -2.1531 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7809 0.1409 3.1938 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4654 1.1074 4.0774 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1296 0.7795 5.4215 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5152 0.7470 5.1693 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9942 1.2198 4.3062 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4306 2.1771 3.4491 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3233 -0.0911 4.1748 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7147 -0.9436 5.1926 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2688 -2.6001 0.6365 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3844 -2.6381 -0.1209 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0765 -1.5481 -0.5894 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3547 -1.5986 0.0119 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3871 -1.7072 -0.8829 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2695 -0.6204 -0.7963 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2945 -0.8649 -1.7107 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.9831 0.4519 -1.9881 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5153 1.0095 -0.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2785 -1.8862 -1.1303 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.6120 -2.8429 -2.1077 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5547 -2.6575 -0.0403 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.4976 -1.9850 1.1543 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1525 -2.9679 -0.5765 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3214 -3.7827 -1.6929 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4774 -0.2491 -0.2245 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1823 5.9142 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1113 5.5657 -3.8668 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4609 6.7485 -4.0813 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1179 2.0036 -1.1549 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3995 0.6070 -2.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8938 1.5337 -2.6488 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1009 -0.8006 -1.5142 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4758 1.8610 -0.4394 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9427 0.6365 0.9816 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6853 -1.7934 3.0078 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5961 0.8210 1.7338 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2266 0.5918 0.0838 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3224 -0.2157 -2.5893 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3112 1.4690 -2.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1844 1.3671 -1.5377 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3212 -1.3587 0.6422 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8970 0.3012 0.5316 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5679 -0.5975 2.6151 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9671 -1.8770 -0.4793 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2346 -1.3944 -2.6892 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 2.1113 3.8149 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8487 -0.2553 5.6808 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8529 1.5388 6.1817 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7555 1.1308 4.3047 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8861 1.6166 5.3687 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7712 3.0641 3.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2187 0.0617 4.3179 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1651 -0.8554 6.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9135 -3.5153 1.0832 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1832 -1.5814 -1.7031 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0028 -1.7492 -1.9204 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8717 -1.2276 -2.6504 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3026 1.1977 -2.4269 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8350 0.3293 -2.6924 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1457 1.7235 -1.0586 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1661 -1.3589 -0.7322 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8250 -2.3553 -2.9414 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0438 -3.6674 0.0856 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1373 -2.3160 1.8374 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 -3.5857 0.1951 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5703 -4.6986 -1.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0928 0.2955 0.5568 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 2 0 8 9 1 0 9 10 1 0 9 11 1 0 11 56 1 0 56 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 47 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 52 54 1 0 54 55 1 0 43 42 1 0 42 41 1 0 41 12 2 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 32 1 0 32 26 1 0 26 25 1 0 25 23 1 0 23 24 2 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 1 0 28 31 1 0 17 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 34 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 56 7 1 0 54 45 1 0 39 16 1 0 12 11 1 0 31 19 1 0 23 22 1 0 31 32 1 0 1 57 1 0 1 58 1 0 1 59 1 0 6 60 1 0 6 61 1 0 8 62 1 0 9 63 1 6 10 64 1 0 11 65 1 1 56 98 1 1 43 86 1 6 45 87 1 6 47 88 1 6 48 89 1 0 48 90 1 0 49 91 1 0 50 92 1 1 51 93 1 0 52 94 1 1 53 95 1 0 54 96 1 1 55 97 1 0 41 85 1 0 16 66 1 1 17 67 1 6 19 68 1 1 21 69 1 0 32 76 1 6 26 70 1 6 27 71 1 0 29 72 1 0 29 73 1 0 30 74 1 0 31 75 1 6 34 77 1 6 35 78 1 0 35 79 1 0 36 80 1 0 37 81 1 1 38 82 1 0 39 83 1 1 40 84 1 0 M END