RDKit 3D 48 49 0 0 0 0 0 0 0 0999 V2000 6.4249 0.4838 2.0911 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6569 -0.0356 0.7587 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8128 0.1980 0.0526 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7556 -0.5567 -1.0879 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5386 -1.2554 -1.0945 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 -0.8906 0.0465 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5123 -1.3698 0.4109 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0824 -2.4815 0.1035 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7163 -0.4612 1.0874 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3483 -0.7866 1.2269 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4511 0.2535 1.0654 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8067 1.4294 1.0359 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0129 -0.2112 0.9798 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 0.9346 0.6344 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4069 0.5273 0.7012 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6882 -0.5746 -0.2479 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2527 -1.7812 0.3818 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2759 -0.1656 -1.7932 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3173 -1.3721 -2.5922 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 1.0101 -2.2508 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9653 0.3160 -1.4797 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2801 1.6679 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6080 2.0405 -1.0799 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6032 1.0672 -1.0738 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2994 -0.2746 -1.2858 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9741 -0.6559 -1.4994 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8761 1.4292 -0.8695 F 0 0 0 0 0 0 0 0 0 0 0 0 9.0559 -0.6782 -2.4275 Br 0 0 0 0 0 0 0 0 0 0 0 0 7.3808 0.7720 2.5371 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7755 1.3584 2.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9668 -0.2953 2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5833 0.8577 0.4302 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1804 -1.9439 -1.8506 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 0.5350 0.9715 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1032 -1.7287 0.9164 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2571 -0.6452 1.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0505 -0.9982 0.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7804 1.7674 1.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6915 1.3180 -0.3629 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6555 0.2221 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0374 1.3957 0.4893 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2245 -1.5677 0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5744 -2.1377 1.1641 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3575 -2.5966 -0.3388 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5046 2.4305 -1.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8755 3.0822 -0.9296 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0980 -1.0103 -1.2943 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7375 -1.7008 -1.6887 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 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 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 16 18 1 0 18 19 2 0 18 20 2 0 18 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 24 27 1 0 4 28 1 0 6 2 1 0 26 21 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 5 33 1 0 9 34 1 0 10 35 1 0 13 36 1 0 13 37 1 0 14 38 1 0 14 39 1 0 15 40 1 0 15 41 1 0 17 42 1 0 17 43 1 0 17 44 1 0 22 45 1 0 23 46 1 0 25 47 1 0 26 48 1 0 M END