RDKit 2D 84 89 0 0 0 0 0 0 0 0999 V2000 5.2358 3.1867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2716 2.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7846 0.6281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7944 2.2981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8302 1.1491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8302 -1.1491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7321 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0311 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5083 0.4895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4725 1.6386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2575 1.5002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9595 3.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9236 4.1972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4106 5.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9334 5.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9692 4.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4822 3.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0311 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5913 -0.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7463 -1.5687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5085 -2.9832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0751 -3.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5287 -4.0828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9807 -5.4791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0246 -3.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4144 -5.3410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9421 -5.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3542 -4.6513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7098 -6.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3093 -3.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8052 -3.2641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6501 -2.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1459 -2.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8394 -0.7627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8695 -2.7314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4274 -1.2980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9232 -1.1859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5740 0.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0698 0.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2977 0.9133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7321 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2000 4.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3848 2.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0867 4.1509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0882 0.3321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8072 2.2461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7944 -2.2981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0882 -0.3321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6811 -2.1132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 2.1308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8291 2.5230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7679 2.6491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5441 2.1595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4008 3.9367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3748 6.7558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4204 7.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 4.9786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6653 2.0506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8074 1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4816 0.6799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3582 -3.8675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5173 -4.8587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5384 -2.0566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1416 -6.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0336 -6.3508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4234 -6.5780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8406 -4.4500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0655 -7.5658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1671 -5.7530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3068 -6.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0884 -1.8702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6417 -2.2489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2580 -0.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0338 -3.6326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0446 -1.7991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0032 0.0871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5656 0.3897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9577 1.7734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9988 -1.2207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2633 -1.8045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4697 -1.9479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 31 30 1 0 30 29 1 0 29 27 1 0 27 28 1 6 27 37 1 0 37 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 2 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 40 42 2 0 38 20 1 0 20 21 1 1 21 22 1 0 22 23 1 0 23 24 1 1 23 43 1 0 43 44 1 0 44 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 8 6 1 0 6 7 1 6 6 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 23 25 1 0 25 26 2 0 32 30 1 0 43 20 1 0 6 44 1 0 25 27 1 0 10 20 1 0 19 14 1 0 31 71 1 0 31 72 1 0 31 73 1 0 30 70 1 1 29 68 1 0 29 69 1 0 28 67 1 0 37 78 1 1 32 74 1 1 35 75 1 0 35 76 1 0 35 77 1 0 38 79 1 6 41 80 1 0 41 81 1 0 41 82 1 0 21 62 1 0 21 63 1 0 24 64 1 0 24 65 1 0 24 66 1 0 43 83 1 6 44 84 1 1 8 53 1 1 9 54 1 0 9 55 1 0 10 56 1 1 15 57 1 0 16 58 1 0 17 59 1 0 18 60 1 0 19 61 1 0 7 50 1 0 7 51 1 0 7 52 1 0 5 48 1 0 5 49 1 0 1 45 1 0 1 46 1 0 1 47 1 0 M END