B26WHV -OEChem-04022105503D 30 31 0 1 0 0 0 0 0999 V2000 -6.9176 0.5313 -0.3680 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0721 1.5042 -0.1053 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4082 3.1985 -0.2686 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7469 -1.7678 0.6339 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5712 -0.6107 -1.8482 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3419 -1.1764 -0.5602 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 0.4901 0.2428 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7214 0.3599 0.3654 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4275 -0.6105 0.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0213 -0.1770 0.2213 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0977 -0.1474 1.7494 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6755 1.7154 -0.0312 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2972 -0.5506 -0.7063 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0187 -1.0076 0.3104 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -0.6376 0.1472 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1718 -0.2650 1.2603 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0043 -0.6704 -1.1156 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5132 0.0848 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3458 -0.3204 -1.2698 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1002 0.0571 -0.1591 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 1.3199 0.2216 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 -0.0896 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6231 0.4551 2.5317 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8145 -1.1925 1.9088 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8608 -2.0629 0.5226 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7255 -0.2401 2.2509 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -0.9636 -1.9884 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0870 0.3768 1.9818 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7879 -0.3473 -2.2624 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9808 -1.2048 -2.5126 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 10 1 0 0 0 0 2 12 1 0 0 0 0 3 12 2 0 0 0 0 4 9 2 0 0 0 0 5 13 1 0 0 0 0 5 30 1 0 0 0 0 6 13 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 10 14 2 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 17 27 1 0 0 0 0 18 20 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 M END $$$$