RDKit 3D 92 93 0 0 0 0 0 0 0 0999 V2000 2.6444 3.5284 3.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4719 3.0244 3.8888 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8979 1.7760 3.3176 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0322 1.2187 3.9213 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4058 1.2838 2.1566 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9233 0.0860 1.5012 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0739 -0.8465 1.4901 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2961 -0.4106 2.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0381 -0.1730 3.4647 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5512 -0.2242 1.8297 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5786 -0.9733 1.2196 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8263 -0.0718 1.3084 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2970 -1.1822 -0.2096 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2031 -1.8367 -1.1326 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6864 -2.7977 -1.9504 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2882 -3.1851 -1.9261 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1396 -2.5895 -2.1772 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5805 -1.3716 -2.5834 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8768 -0.3082 -1.9034 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6624 -0.8334 -3.6343 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3805 0.3364 -4.2744 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4716 -0.1451 -2.8657 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0183 -1.0175 -1.7765 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6517 -2.2932 -2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7975 -2.1220 -3.1644 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2459 -1.0576 -3.5622 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5706 -0.4451 -0.5205 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8095 0.1146 -0.7191 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8969 -0.4662 -0.1243 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7726 -1.1556 -0.8976 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8358 -0.4185 -1.3305 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5383 0.8444 -2.0532 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8029 -0.2548 -0.1743 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.6737 -1.3319 -0.0377 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0129 -0.0635 1.1323 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7246 0.7504 2.0491 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9706 0.2877 2.5264 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0485 1.7525 2.7558 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6196 0.4028 0.8418 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8557 0.4509 2.0179 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3101 0.5267 0.2233 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3778 1.7558 0.3934 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1712 2.8278 -0.2245 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3009 4.0819 2.1844 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 2.6960 2.7325 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2373 4.2669 3.6961 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7614 2.9349 4.9473 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6858 3.8467 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0788 -0.2564 2.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7263 -1.7529 2.1058 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3348 -1.2773 0.5454 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8412 -1.8917 1.7684 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5592 0.9423 0.9624 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1581 -0.1036 2.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6501 -0.5150 0.6943 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3383 -1.7734 -0.2429 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1648 -0.1409 -0.6105 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2322 -1.5753 -1.1795 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 -3.2538 -2.6188 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2209 -4.3115 -1.6677 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -3.3417 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3361 -1.4454 -4.4334 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7789 0.6885 -5.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4232 0.0908 -4.5422 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3882 1.1762 -3.5248 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2613 0.1198 -3.6164 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9073 0.7753 -2.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9826 -1.4540 -1.3555 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1086 -2.8944 -2.8214 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -2.9118 -1.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3522 -2.9989 -3.5564 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -1.3434 0.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4033 -1.2903 0.5169 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3927 -1.0833 -2.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7931 0.8047 -3.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1370 1.6949 -1.6562 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4597 1.0804 -2.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3894 0.6673 -0.3145 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5590 -1.0987 -0.4679 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 -1.0794 1.5639 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9164 -0.4027 3.3766 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6113 -0.0910 1.6987 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5184 1.1939 2.9235 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3292 1.4178 3.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8185 2.3401 3.3343 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5935 2.5180 2.0627 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7285 1.4583 0.4743 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9535 -0.3201 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1353 0.8352 -0.4226 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 2.7566 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4865 3.7014 -0.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1681 3.1268 0.2311 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 2 0 8 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 23 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 33 35 1 0 35 39 1 0 39 40 1 0 35 36 1 0 36 37 1 0 36 38 1 0 27 41 1 0 41 42 1 0 42 43 1 0 41 6 1 0 39 29 1 0 1 44 1 0 1 45 1 0 1 46 1 0 2 47 1 0 2 48 1 0 6 49 1 1 7 50 1 0 7 51 1 0 11 52 1 1 12 53 1 0 12 54 1 0 12 55 1 0 13 56 1 0 13 57 1 0 14 58 1 0 15 59 1 0 16 60 1 0 17 61 1 0 20 62 1 6 21 63 1 0 21 64 1 0 21 65 1 0 22 66 1 0 22 67 1 0 23 68 1 1 24 69 1 0 24 70 1 0 25 71 1 0 27 72 1 1 29 73 1 1 31 74 1 6 32 75 1 0 32 76 1 0 32 77 1 0 33 78 1 6 34 79 1 0 35 80 1 1 39 87 1 6 40 88 1 0 37 81 1 0 37 82 1 0 37 83 1 0 38 84 1 0 38 85 1 0 38 86 1 0 41 89 1 6 43 90 1 0 43 91 1 0 43 92 1 0 M END