RDKit 3D 102104 0 0 0 0 0 0 0 0999 V2000 7.2143 -0.4353 1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3305 0.2660 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5411 0.1782 1.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8849 -0.5612 2.8566 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4119 0.4007 3.7497 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0563 1.0518 -0.1345 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5488 0.3038 -1.3086 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3042 -0.4337 -1.1501 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1573 -0.1699 -1.7861 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1349 0.9577 -2.7276 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9682 -0.9785 -1.5583 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0291 -1.9576 -0.7526 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7456 -0.7510 -2.1688 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6133 -1.5609 -1.9165 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4889 -0.7577 -1.2801 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9497 0.0831 -0.2967 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6255 1.4164 -0.5437 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8198 2.1135 -0.8897 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 3.4462 -0.6795 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3707 3.9984 0.3551 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5598 5.4121 0.5718 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2929 6.0989 -0.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5362 3.1950 1.2408 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3982 2.7006 2.2525 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5877 3.9382 1.9065 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7623 3.7613 0.9734 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5314 2.4625 0.2748 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7746 2.7036 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4684 1.4730 0.6941 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8313 1.6034 0.5729 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3111 2.6267 0.0738 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7354 0.5363 1.0326 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1844 -0.6920 1.6317 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0298 0.6701 0.9133 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9708 -0.4035 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7675 -0.8733 0.1927 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7032 -1.9500 0.6069 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6122 -2.5680 -0.4252 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7298 -2.3507 1.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6740 -3.4284 2.2573 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5499 -2.9173 3.2437 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1411 2.0431 0.5666 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3754 -1.7070 -0.7508 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9214 -2.5527 -1.6594 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9746 -3.9410 -0.9975 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7344 -3.9561 0.1432 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2837 -2.7151 -2.9768 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1662 -2.2012 -3.9598 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0484 -2.1122 -3.1960 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9298 -2.9870 -3.8279 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2492 0.0250 1.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3031 -0.1660 2.8743 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2375 -1.5199 1.6825 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3223 0.7125 1.0724 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7349 -1.2776 2.6836 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0439 -1.0476 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0614 -0.0251 4.3836 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3688 1.9134 0.1353 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9849 1.5974 -0.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3468 -0.4638 -1.5619 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5513 0.9987 -2.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 -1.2906 -0.4769 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2579 1.9448 -2.2685 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9868 0.8232 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 0.8773 -3.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8314 -2.3853 -1.2288 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.2113 -2.0836 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0277 1.4136 -1.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5999 4.0469 -1.3068 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1065 5.9343 1.3713 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0698 1.7911 2.4597 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 4.9757 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8127 3.4316 2.8925 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7466 4.6353 0.2862 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6789 3.7560 1.6075 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6938 3.2845 -1.4014 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8867 3.1703 -1.6892 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9321 1.7218 -1.6804 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 -1.5439 0.9779 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0716 -0.6878 1.6372 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5876 -0.7987 2.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4991 1.5494 0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3667 -1.2238 1.7647 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6168 0.0112 2.1744 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1047 -1.2198 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3946 -0.0518 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6778 -2.3901 -0.1705 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3643 -2.1759 -1.4196 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3817 -3.6611 -0.4514 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0725 -1.9116 2.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2876 -3.6853 1.3737 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1300 -4.3224 2.6555 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2528 -3.2912 4.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 1.2469 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -2.2759 -1.7589 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2958 -4.7160 -1.7129 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1054 -4.1719 -0.7668 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3704 -4.7148 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2008 -3.8079 -3.2707 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9145 -2.4968 -4.8507 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9363 -1.2261 -3.8876 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7583 -2.5158 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 9 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 20 23 1 0 23 24 1 1 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 27 29 1 1 29 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 32 34 2 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 37 39 2 0 39 40 1 0 40 41 1 0 27 42 1 0 15 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 44 47 1 0 47 48 1 0 47 49 1 0 49 50 1 0 2 3 2 0 3 4 1 0 4 5 1 0 49 14 1 0 42 17 1 0 42 23 1 0 1 51 1 0 1 52 1 0 1 53 1 0 6 58 1 0 6 59 1 0 7 60 1 0 7 61 1 0 8 62 1 0 10 63 1 0 10 64 1 0 10 65 1 0 14 66 1 1 15 67 1 6 17 68 1 6 19 69 1 0 21 70 1 0 24 71 1 0 25 72 1 0 25 73 1 0 26 74 1 0 26 75 1 0 28 76 1 0 28 77 1 0 28 78 1 0 33 79 1 0 33 80 1 0 33 81 1 0 34 82 1 0 35 83 1 0 35 84 1 0 36 85 1 0 36 86 1 0 38 87 1 0 38 88 1 0 38 89 1 0 39 90 1 0 40 91 1 0 40 92 1 0 41 93 1 0 42 94 1 1 44 95 1 6 45 96 1 0 45 97 1 0 46 98 1 0 47 99 1 6 48100 1 0 49101 1 6 50102 1 0 3 54 1 0 4 55 1 0 4 56 1 0 5 57 1 0 M END