RDKit 3D 90 94 0 0 0 0 0 0 0 0999 V2000 0.2394 3.8173 -1.3628 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1415 2.8042 -0.5422 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1835 1.5344 -1.0611 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6378 1.1757 -1.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2062 0.1499 -0.5082 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6955 -0.0183 -0.6612 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3467 1.1946 -0.1232 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7236 2.1715 -1.2471 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5464 1.0342 0.7231 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6046 2.0518 1.8453 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7208 -0.3240 1.3351 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6279 -1.3284 0.2445 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1964 -1.3469 -0.2544 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2133 -2.3156 -1.4497 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4016 -2.0410 0.8263 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9734 -2.1600 0.3665 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3571 -0.7847 0.2478 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0517 -0.3435 1.6622 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0588 -0.8306 -0.5858 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5089 -1.0631 -2.0074 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6658 -2.0426 -0.1443 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1007 -1.9534 -0.6705 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6843 -0.7415 0.0047 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1501 -0.8172 0.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5230 -1.4641 1.4321 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6047 -1.8824 -0.9384 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9663 0.4020 -0.0562 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9674 0.4853 0.9453 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3106 0.4581 0.7124 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3185 0.5489 1.7991 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6695 0.3498 -0.4966 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2049 1.6852 -0.2026 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7711 1.6055 0.1999 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0928 0.5051 -0.6263 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4818 0.6855 -2.0475 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6171 0.4870 -0.3800 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1935 4.7588 -0.7339 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4754 4.0190 -2.2001 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2848 3.7815 -1.7083 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1921 1.6385 -2.1237 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2626 1.8781 -1.6563 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8351 0.0230 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6098 1.7841 0.5045 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 1.6533 -2.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2382 3.1392 -1.1667 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8331 2.3834 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4795 1.2198 0.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8551 3.0572 1.4949 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5786 2.1063 2.2787 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2599 1.7067 2.6779 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1264 -0.4953 2.2271 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7961 -0.3523 1.6956 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2748 -1.0204 -0.5808 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8425 -2.3540 0.6072 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8913 -1.7835 -2.3701 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6357 -3.2359 -1.2438 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2513 -2.6545 -1.6336 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -1.5095 1.7854 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -3.0794 0.9228 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8131 -2.7908 -0.5016 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4479 -2.7046 1.2113 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0273 -0.6964 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1799 0.7485 1.8054 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7164 -0.8065 2.4211 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5562 -1.4186 -2.0786 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0856 -1.8979 -2.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4235 -0.2210 -2.6827 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6423 -2.2826 0.9179 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2262 -2.9293 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5824 -2.8919 -0.4023 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0284 -1.8485 -1.7708 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2686 -0.7302 1.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 -2.5535 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 -1.4408 1.6039 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9148 -1.0372 2.2495 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6179 -2.8886 -0.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0633 -1.7957 -1.8874 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -1.6266 -1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5752 0.3138 -1.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2935 1.5361 2.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3239 0.3932 1.4058 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 -0.2477 2.5779 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2424 2.1185 -1.2239 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6692 2.4866 0.4482 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6248 1.3055 1.2598 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3469 2.5902 0.0769 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2127 1.7077 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5475 0.5137 -2.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9471 -0.0028 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5352 0.7443 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 6 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 1 17 19 1 0 19 20 1 6 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 24 27 1 0 27 32 1 0 32 33 1 0 33 34 1 0 34 35 1 6 34 36 1 0 27 28 1 0 28 29 1 0 29 30 1 0 29 31 2 0 36 3 1 0 17 5 1 0 36 19 1 0 13 6 1 0 34 23 1 0 1 37 1 0 1 38 1 0 1 39 1 0 3 40 1 6 4 41 1 0 6 42 1 6 7 43 1 1 8 44 1 0 8 45 1 0 8 46 1 0 9 47 1 6 10 48 1 0 10 49 1 0 10 50 1 0 11 51 1 0 11 52 1 0 12 53 1 0 12 54 1 0 14 55 1 0 14 56 1 0 14 57 1 0 15 58 1 0 15 59 1 0 16 60 1 0 16 61 1 0 18 62 1 0 18 63 1 0 18 64 1 0 20 65 1 0 20 66 1 0 20 67 1 0 21 68 1 0 21 69 1 0 22 70 1 0 22 71 1 0 23 72 1 1 25 73 1 0 25 74 1 0 25 75 1 0 26 76 1 0 26 77 1 0 26 78 1 0 27 79 1 6 32 83 1 0 32 84 1 0 33 85 1 0 33 86 1 0 35 87 1 0 35 88 1 0 35 89 1 0 36 90 1 1 30 80 1 0 30 81 1 0 30 82 1 0 M END