RDKit 3D 101107 0 0 0 0 0 0 0 0999 V2000 -5.4824 -2.5454 -5.8243 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8155 -1.3543 -5.3994 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1579 -1.3120 -4.1919 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1329 -2.3035 -3.4549 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4801 -0.0665 -3.7814 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -0.2438 -2.4240 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1368 1.0197 -1.9819 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2453 1.0647 -0.4647 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9165 -0.3567 0.4273 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4738 -1.2277 0.6801 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2214 -1.8906 -0.5115 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1388 -0.9085 -1.2114 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1535 -1.5455 -2.0821 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1453 -2.4631 -1.5435 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0731 -1.9607 -0.6389 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9044 -1.0036 -1.2080 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8271 0.1427 -0.4416 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5323 1.2179 -0.9133 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7980 2.1453 0.2143 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4004 1.8768 1.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4909 3.3341 0.0297 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8851 0.8215 -1.4682 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8180 0.6750 -2.8379 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3112 -0.4664 -0.7868 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4173 -0.2078 0.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3238 -1.5821 -1.0673 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7036 -2.2696 -2.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5225 0.1712 -0.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6476 0.0987 0.8731 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8716 1.5126 1.4055 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6163 -0.6446 1.5950 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2922 -1.7501 2.2121 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0918 0.0075 2.7036 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0001 1.2018 3.0263 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9786 -0.8783 3.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4305 -0.5703 4.7394 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0675 0.5815 5.3495 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2856 -1.4778 5.4101 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6667 -2.6520 4.8166 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2155 -2.9544 3.5563 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3687 -2.0820 2.8598 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -2.4284 1.5225 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8768 -3.5921 1.1265 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6726 2.3647 0.0401 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8074 2.9884 -0.6302 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1206 2.9012 1.3029 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4262 3.8931 1.9511 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8568 4.4045 3.1737 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 3.9081 3.7418 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 2.9021 3.1064 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8618 2.4159 3.6844 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2753 2.4173 1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9805 1.3522 1.1767 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6806 0.5493 1.8047 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 1.3342 -0.2929 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0625 2.6127 -0.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5689 0.2908 -1.0118 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7370 -0.2687 -0.2821 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7331 -0.7027 -1.4754 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7229 -3.3368 -5.9718 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2131 -2.8024 -5.0117 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0054 -2.2714 -6.7725 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6952 0.1206 -4.5708 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1061 0.8234 -3.7614 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -1.0383 -2.5628 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7892 1.8534 -2.3954 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1603 1.2047 -2.3896 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5968 -2.2626 -1.1566 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.8098 -0.1791 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4155 -0.4340 -1.9892 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7043 -0.6896 -2.5814 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6654 -2.0517 -2.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7821 -2.8973 -2.3762 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7441 -3.3728 -1.0383 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7018 -0.7780 -2.2556 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 1.7828 -1.7064 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4837 3.3783 -0.1386 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6686 1.5748 -1.2372 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6612 0.3742 -3.2267 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2837 -0.7610 -1.2091 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3538 -0.3040 0.8315 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3873 -2.2917 -0.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 -1.7187 -2.9898 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6688 -0.3790 1.0435 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0316 2.1652 1.1912 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7252 1.9094 0.7795 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2392 1.4948 2.4335 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0958 -1.3155 2.6097 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4992 1.3080 5.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6248 -1.2169 6.3973 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3344 -3.3378 5.3659 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -3.8728 3.0868 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5181 4.3120 1.5369 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2774 5.1847 3.6468 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3350 4.2910 4.6759 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5186 1.7430 3.4314 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7683 2.6300 -1.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9896 0.7888 -1.9387 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5127 -1.1049 0.4032 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4453 -0.7212 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3373 0.5479 0.1760 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 1 10 9 1 6 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 18 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 12 28 1 0 28 29 1 0 29 30 1 0 29 31 1 0 31 32 1 1 31 33 1 0 33 34 2 0 33 35 1 0 35 36 2 0 36 37 1 0 36 38 1 0 38 39 2 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 2 0 8 44 1 0 44 45 2 0 44 46 1 0 46 47 2 0 47 48 1 0 48 49 2 0 49 50 1 0 50 51 1 0 50 52 2 0 52 53 1 0 53 54 2 0 53 55 1 0 55 56 1 6 55 57 1 0 57 58 1 0 57 59 1 0 59 6 1 0 55 8 1 0 31 10 1 0 41 35 1 0 52 46 1 0 42 10 1 0 26 16 1 0 1 60 1 0 1 61 1 0 1 62 1 0 5 63 1 0 5 64 1 0 6 65 1 6 7 66 1 0 7 67 1 0 11 68 1 0 11 69 1 0 12 70 1 6 13 71 1 0 13 72 1 0 14 73 1 0 14 74 1 0 16 75 1 6 18 76 1 6 21 77 1 0 22 78 1 6 23 79 1 0 24 80 1 6 25 81 1 0 26 82 1 1 27 83 1 0 29 84 1 6 30 85 1 0 30 86 1 0 30 87 1 0 32 88 1 0 37 89 1 0 38 90 1 0 39 91 1 0 40 92 1 0 47 93 1 0 48 94 1 0 49 95 1 0 51 96 1 0 56 97 1 0 57 98 1 6 58 99 1 0 58100 1 0 58101 1 0 M END