B32TIF -OEChem-04012113323D 29 30 0 0 0 0 0 0 0999 V2000 1.5518 -2.8262 0.9908 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.4489 1.5505 1.3748 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8467 0.1733 -2.3830 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4111 1.0478 0.1412 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6862 1.3143 2.1069 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1743 2.8690 1.3609 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2814 -1.4504 -0.5008 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6604 -1.4047 1.1209 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7442 0.3901 1.8601 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2724 0.4298 -0.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8801 1.2473 -0.2587 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5998 0.1542 -0.6887 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 2.1121 -1.3347 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7521 0.0934 0.8137 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1217 -1.1455 0.4182 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 1.6470 -2.5457 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -0.8798 -0.5732 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1331 -0.9343 0.0667 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8539 -1.8394 -1.3823 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9095 -2.5489 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -0.4619 2.3025 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0391 3.0303 -1.2449 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8652 2.1015 -3.5184 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5325 -1.3337 -2.0777 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4596 -2.4864 -0.7395 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1836 -2.4715 -1.9739 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2262 -3.4020 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7949 -2.8363 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2212 -2.2478 1.1745 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 3 12 1 0 0 0 0 3 16 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 7 18 1 0 0 0 0 7 20 1 0 0 0 0 8 18 2 0 0 0 0 9 14 1 0 0 0 0 9 21 1 0 0 0 0 10 17 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 18 1 0 0 0 0 13 16 2 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 15 17 1 0 0 0 0 16 23 1 0 0 0 0 17 19 1 0 0 0 0 19 24 1 0 0 0 0 19 25 1 0 0 0 0 19 26 1 0 0 0 0 20 27 1 0 0 0 0 20 28 1 0 0 0 0 20 29 1 0 0 0 0 M END $$$$