RDKit 3D 87 91 0 0 0 0 0 0 0 0999 V2000 -4.4872 1.6124 -3.1657 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6884 1.4600 -2.1492 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 2.4288 -1.7141 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3323 1.7524 -1.7472 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2417 0.4387 -1.0101 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8430 0.5861 0.4157 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5033 1.2482 0.5946 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6296 0.5167 -0.0446 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8141 -0.8886 0.4875 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1548 -1.3701 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -0.4947 0.3871 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7309 0.5423 1.1575 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9106 1.2663 0.2919 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9263 0.1362 -0.6848 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2274 0.5270 -0.3029 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7477 1.4933 -1.1289 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2371 0.9458 1.1433 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4164 2.0672 1.5144 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9937 -0.2152 2.0817 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3421 -1.2576 1.1580 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7837 -2.4116 1.9231 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3339 -1.7458 0.3082 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0485 -0.7662 -0.3300 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4045 -0.5479 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3103 -1.0794 -1.7911 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4052 -0.4418 -1.2460 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4416 -1.7122 -0.4667 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2413 -0.9434 -2.7265 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7427 0.2199 -1.2663 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3463 0.6578 0.0058 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5234 -0.3528 1.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5842 -1.1094 1.1194 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8094 -2.1700 2.1885 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3155 -1.9917 2.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8320 -1.7237 1.0998 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7922 -1.2130 0.3195 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9220 -0.9075 -0.8711 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6450 1.2298 -0.2403 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0014 2.5039 0.0904 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3612 2.9967 -0.2051 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1812 3.2603 0.6443 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4703 2.4674 -3.7969 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2063 0.8299 -3.3813 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 2.8315 -0.7016 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6322 3.2316 -2.4881 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1135 1.5308 -2.8336 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5545 2.4452 -1.4245 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3516 -0.0820 -1.4921 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6901 -0.4529 0.8366 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5358 1.0844 1.0834 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6907 1.2396 1.7053 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5325 2.2973 0.2929 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5819 0.4514 -1.1331 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0554 -1.5941 0.1273 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8065 -0.8271 1.5886 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3281 -2.4381 0.1507 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -1.2700 -1.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6979 2.2535 0.7678 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5172 1.4836 -0.6113 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5270 2.3971 -0.7732 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9301 -0.6015 2.5016 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2745 0.1382 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -2.3027 2.1978 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 -2.6093 2.8508 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8632 -3.3377 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4289 0.4182 0.8869 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6395 -1.4143 0.9854 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2191 -0.4906 -0.4231 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8771 -0.2467 -2.2329 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9322 -1.9917 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3641 -1.1792 -2.3651 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8174 -2.5178 -0.9758 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2109 -1.6668 0.5883 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4883 -2.1317 -0.5854 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4713 -0.1160 -3.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -1.3931 -2.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0002 -1.7410 -2.8491 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4493 -0.4560 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7943 1.5011 0.4978 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7744 -0.5086 1.8451 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2548 -1.9273 3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5492 -3.1215 1.7224 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4764 -1.1503 3.0724 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7078 -2.9466 2.7201 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0471 2.6662 0.6163 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7686 2.6012 -1.1641 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4230 4.0993 -0.2744 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 1 12 13 1 0 11 14 1 0 14 15 1 0 15 16 1 6 15 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 1 20 22 1 0 22 23 1 0 23 24 1 1 23 25 1 0 5 26 1 0 26 27 1 1 26 28 1 0 26 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 2 0 30 38 1 0 38 39 1 0 39 40 1 0 39 41 2 0 29 2 1 0 36 32 1 0 13 8 1 0 23 15 1 0 20 11 1 0 1 42 1 0 1 43 1 0 3 44 1 0 3 45 1 0 4 46 1 0 4 47 1 0 5 48 1 6 6 49 1 0 6 50 1 0 7 51 1 0 7 52 1 0 8 53 1 6 9 54 1 0 9 55 1 0 10 56 1 0 10 57 1 0 13 58 1 0 13 59 1 0 16 60 1 0 19 61 1 0 19 62 1 0 21 63 1 0 21 64 1 0 21 65 1 0 24 66 1 0 24 67 1 0 24 68 1 0 25 69 1 0 25 70 1 0 25 71 1 0 27 72 1 0 27 73 1 0 27 74 1 0 28 75 1 0 28 76 1 0 28 77 1 0 29 78 1 6 30 79 1 1 31 80 1 0 33 81 1 0 33 82 1 0 34 83 1 0 34 84 1 0 40 85 1 0 40 86 1 0 40 87 1 0 M END