RDKit 3D 53 55 0 0 0 0 0 0 0 0999 V2000 -4.9944 2.1981 0.0921 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 1.3279 0.5602 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0375 0.7880 -0.6117 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.3985 1.8524 -1.4902 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3549 2.6833 -0.7682 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0662 -0.2898 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4693 -1.1207 -1.2729 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5294 -2.1222 -0.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -1.7191 -0.5518 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1047 -0.4505 -0.4599 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4848 -0.3116 -0.3299 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1881 0.9090 -0.1501 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5868 0.8606 -0.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2737 -0.3515 -0.1077 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5933 -1.5560 -0.2879 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1966 -1.5115 -0.3969 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0912 -2.8104 -0.6388 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4364 2.0567 -0.1006 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1221 3.2784 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0877 4.3881 0.2334 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0516 -3.3798 -0.4218 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0999 -3.7576 -0.9532 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4627 -4.1455 0.6609 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4654 -5.5041 0.9175 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2009 -5.6869 2.1546 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -4.4299 2.5971 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -3.4874 1.7109 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4542 -4.0381 4.2167 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.6436 3.1494 -0.3184 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6488 2.4340 0.9378 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5964 1.6900 -0.6681 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 1.8631 1.2301 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2481 0.4587 1.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7193 0.3014 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9657 1.3450 -2.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 2.4844 -1.8732 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5182 2.0753 -0.4154 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9439 3.4309 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7771 3.2235 0.0834 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6407 -0.9554 0.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3055 0.2014 0.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9381 -0.4943 -1.9974 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2799 -1.6069 -1.8273 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1777 1.7620 0.0946 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3595 -0.3594 -0.0208 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1337 -2.4970 -0.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6414 3.2192 1.1345 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 3.5000 -0.6313 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3455 4.1804 1.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5438 4.4614 -0.7142 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5612 5.3511 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8956 -6.2673 0.2817 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3983 -6.6209 2.6636 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 3 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 12 18 1 0 18 19 1 0 19 20 1 0 8 21 1 0 21 22 2 0 21 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 26 28 1 0 17 9 1 0 16 11 1 0 27 23 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 2 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 6 41 1 0 7 42 1 0 7 43 1 0 13 44 1 0 14 45 1 0 15 46 1 0 19 47 1 0 19 48 1 0 20 49 1 0 20 50 1 0 20 51 1 0 24 52 1 0 25 53 1 0 M CHG 1 3 1 M END