RDKit 3D 85 90 0 0 0 0 0 0 0 0999 V2000 -0.0211 0.1639 -3.1596 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2972 -0.4155 -1.8245 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -0.4837 -1.4316 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8071 -0.8852 -1.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4784 -1.4236 0.2427 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8317 -1.4691 0.6035 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3941 -1.9432 1.7964 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9262 -3.2289 1.6002 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1461 -3.1981 0.9452 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1348 -2.6683 1.9925 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8615 -3.2775 3.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7884 -1.1826 2.1375 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2148 -0.5708 0.9575 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2497 0.3338 1.1885 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9350 1.6364 0.8796 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7404 2.2090 -0.0868 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3806 3.6975 -0.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1513 4.3524 -1.0927 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2029 2.1564 0.2555 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.9494 2.4847 -0.8786 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6101 0.8203 0.7995 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.7350 0.3701 0.0864 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5056 -0.1746 0.5186 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3928 -0.3167 -0.8463 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3515 -1.0103 2.4540 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2100 -1.0822 3.8515 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5131 -1.8692 1.0175 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8263 -1.8009 0.6022 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8804 -2.2564 1.3975 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1599 -1.2760 -0.6238 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5362 -1.2101 -1.0745 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0782 -2.2414 -1.7961 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2679 -3.4633 -2.1494 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3792 -2.1525 -2.2016 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -1.0377 -1.9085 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4849 -1.0235 -2.3482 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6395 -0.0125 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3065 -0.1190 -0.7776 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6886 0.9430 -0.0074 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4729 0.8638 0.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 2.1218 0.3429 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8048 3.1059 1.0879 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4961 4.2366 1.4437 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 4.3544 1.0539 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4740 3.3767 0.3006 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7547 3.5655 -0.0471 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7726 2.2299 -0.0596 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4283 1.1700 -0.8419 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6167 1.2951 -1.1897 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1148 -0.8161 -1.4272 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4594 -0.2853 -2.6705 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6401 1.0546 -3.0586 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9671 0.5233 -3.6456 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4799 -0.5963 -3.7859 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5574 -2.1258 2.5269 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4421 -4.2180 0.6964 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1479 -2.5006 0.0908 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1631 -2.8372 1.6718 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5992 -4.2297 3.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3897 -0.7718 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4532 0.3113 2.2919 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5368 1.8257 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6192 4.1747 0.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3184 3.8338 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0334 4.6449 -0.7413 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4533 2.9257 1.0387 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5457 2.1997 -1.7181 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8003 0.8384 1.8921 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7554 -0.6010 0.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7306 -1.1518 1.0095 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7984 -1.0491 -1.1402 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0653 0.0298 2.1102 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3469 -1.4779 4.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3195 -2.2977 1.9976 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7026 -2.6622 2.3267 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -3.2021 -2.9897 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9473 -4.2458 -2.4996 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7072 -3.7853 -1.2604 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8448 -2.9454 -2.7728 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 -0.4026 -2.2698 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7565 2.9834 1.3886 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0071 5.0105 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3581 5.2402 1.3258 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4499 3.1324 -0.5257 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3994 -0.2213 -2.9786 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 50 2 0 50 51 1 0 50 30 1 0 30 28 2 0 28 29 1 0 28 27 1 0 27 5 2 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 10 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 16 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 12 25 1 0 25 26 1 0 30 31 1 0 31 32 2 0 32 33 1 0 32 34 1 0 34 35 2 0 35 36 1 0 35 37 1 0 37 38 2 0 38 39 1 0 39 40 2 0 39 41 1 0 41 42 2 0 42 43 1 0 43 44 2 0 44 45 1 0 45 46 1 0 45 47 2 0 47 48 1 0 48 49 2 0 5 4 1 0 25 7 1 0 38 31 1 0 47 41 1 0 23 14 1 0 48 37 1 0 1 52 1 0 1 53 1 0 1 54 1 0 51 85 1 0 29 75 1 0 27 74 1 0 7 55 1 1 9 56 1 0 9 57 1 0 10 58 1 6 11 59 1 0 12 60 1 1 14 61 1 1 16 62 1 6 17 63 1 0 17 64 1 0 18 65 1 0 19 66 1 1 20 67 1 0 21 68 1 1 22 69 1 0 23 70 1 1 24 71 1 0 25 72 1 6 26 73 1 0 33 76 1 0 33 77 1 0 33 78 1 0 34 79 1 0 36 80 1 0 42 81 1 0 43 82 1 0 44 83 1 0 46 84 1 0 M END