BY95TF -OEChem-04042106083D 35 36 0 0 0 0 0 0 0999 V2000 -3.8103 2.9890 2.6571 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.7022 -0.7501 -2.1567 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5027 -0.5189 0.2509 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8608 -1.0983 -2.9577 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5739 -0.0808 -2.7751 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 -1.5419 2.9242 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0705 3.2385 -0.5887 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3011 1.3969 -1.0982 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1655 -2.1502 -1.3081 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2808 0.2763 -0.8357 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -1.9900 -0.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0087 -1.4153 -0.4644 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5881 -2.4089 1.0521 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9111 -1.2595 0.5878 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4077 1.1663 -0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6097 0.1949 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -1.6786 1.8721 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3144 -2.2534 2.1043 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8636 1.9749 0.8308 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0657 1.0033 0.6213 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1925 1.8934 1.2467 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0186 1.1125 -0.3775 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2498 1.9000 -0.7226 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8695 -2.8867 -1.1678 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2951 -1.1254 -1.4715 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5598 -2.8561 1.2452 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3708 1.2537 -0.5207 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3048 -0.4965 -0.8877 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0289 -2.5841 3.0993 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1705 2.6639 1.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1037 0.9263 0.9345 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4592 1.6347 0.4047 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4028 1.0278 -1.2768 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9987 -1.8898 3.7284 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8794 3.7414 -0.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 3 14 1 0 0 0 0 3 22 1 0 0 0 0 6 17 1 0 0 0 0 6 34 1 0 0 0 0 7 23 1 0 0 0 0 7 35 1 0 0 0 0 8 23 2 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 18 2 0 0 0 0 13 26 1 0 0 0 0 14 17 2 0 0 0 0 15 19 1 0 0 0 0 15 27 1 0 0 0 0 16 20 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 18 29 1 0 0 0 0 19 21 2 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 M END $$$$