RDKit 3D 87 90 0 0 0 0 0 0 0 0999 V2000 -2.8123 0.5054 1.2838 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8608 1.2044 -0.0844 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5553 1.4457 -0.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8244 0.3493 -0.7820 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5015 0.6939 -1.0035 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3718 0.0408 -0.1629 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3971 0.9777 0.3916 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7788 2.1860 0.9916 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0277 2.8948 0.0916 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 0.3248 1.3507 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0234 -0.5594 0.6587 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9876 0.0542 -0.1092 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2753 -0.2062 0.2916 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0872 -0.9156 -0.8005 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5355 -0.6995 -2.0428 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5195 -0.4671 -0.6804 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3537 -1.5409 -1.0701 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8327 -0.2051 0.7689 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6113 -1.3695 1.5155 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0951 0.8053 1.3348 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9454 1.1081 0.6291 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0255 1.9123 1.5268 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6904 3.0989 1.9135 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2845 -1.5627 -0.1722 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6112 -2.4133 0.7252 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2003 -0.9473 -1.0419 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4045 -1.9112 -1.5997 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3519 -0.2745 -2.0700 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4754 0.0394 -3.0923 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 0.2612 -2.3473 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6055 1.5789 -2.7737 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5207 0.2582 -1.0433 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8739 0.6097 -1.3613 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8048 0.6005 -0.2866 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9945 -0.7310 0.3432 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1428 -1.3873 0.4124 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1421 -2.7378 1.0955 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0143 -2.6996 2.1799 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4187 -0.8507 -0.1500 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.0941 -0.2244 0.8981 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0743 0.1144 -1.2373 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.2631 0.7755 -1.5943 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1040 1.1758 -0.8019 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.8629 1.9908 -1.9212 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 0.8123 1.9478 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8333 -0.5874 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8562 0.7358 1.8037 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4463 2.1413 0.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8391 -0.3848 0.0507 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8208 -0.5671 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0424 1.2844 -0.4827 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1223 1.8327 1.8398 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5362 2.8464 1.5083 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4299 2.8841 -0.8295 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5635 -1.1453 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3463 -0.8648 1.1722 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0838 -2.0312 -0.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0702 -1.1737 -2.7035 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6958 0.4166 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2021 -1.5184 -0.5225 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9138 0.0992 0.8386 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0205 -1.2373 2.4295 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1994 1.6853 -0.2737 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1150 2.2583 0.9919 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7681 1.3845 2.4482 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1426 3.5083 1.1422 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9928 -2.1459 -0.7528 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8482 -3.3742 0.5499 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6974 -0.3736 -1.8385 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5293 -2.7607 -1.0995 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4537 -1.3571 -1.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8916 0.6124 -3.7984 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2607 -0.2966 -3.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3912 1.9361 -3.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4243 -0.7713 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2271 0.2664 -2.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4565 1.2969 0.5018 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1194 -1.2079 0.7841 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5579 -3.4741 0.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1268 -3.0405 1.3465 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4264 -3.5855 2.2691 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9892 -1.6892 -0.5981 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5597 -0.1993 1.7301 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7439 -0.4386 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7646 0.9029 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6071 1.8196 -0.0541 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7515 2.1982 -2.3332 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 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 7 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 21 1 0 21 22 1 0 22 23 1 0 21 20 1 0 20 18 1 0 18 19 1 0 18 16 1 0 16 17 1 0 16 14 1 0 14 15 1 0 11 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 4 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 1 0 36 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 32 2 1 0 43 34 1 0 26 6 1 0 14 13 1 0 1 45 1 0 1 46 1 0 1 47 1 0 2 48 1 1 4 49 1 1 6 50 1 1 7 51 1 6 8 52 1 0 8 53 1 0 9 54 1 0 11 55 1 1 13 56 1 1 21 63 1 6 22 64 1 0 22 65 1 0 23 66 1 0 18 61 1 6 19 62 1 0 16 59 1 6 17 60 1 0 14 57 1 1 15 58 1 0 24 67 1 6 25 68 1 0 26 69 1 6 27 70 1 0 28 71 1 1 29 72 1 0 30 73 1 6 31 74 1 0 32 75 1 1 33 76 1 0 34 77 1 1 35 78 1 0 37 79 1 0 37 80 1 0 38 81 1 0 39 82 1 6 40 83 1 0 41 84 1 6 42 85 1 0 43 86 1 1 44 87 1 0 M END