BR4I5C -OEChem-04022117083D 49 52 0 0 0 0 0 0 0999 V2000 1.5264 -0.0500 -1.1128 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9985 1.1583 -0.3723 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0152 -2.7060 0.5099 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4520 2.6382 0.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1382 0.2277 0.3696 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8649 0.3489 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0217 -0.2494 1.4429 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0422 1.3171 -0.7749 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2042 0.6989 1.6466 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9819 0.9021 0.3513 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9887 -0.6640 0.2191 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8131 0.0872 -0.3976 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5925 -0.8108 -0.5468 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2587 -0.4199 -0.7825 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3344 -1.1769 -0.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0571 0.1589 -0.3968 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7561 0.5367 -0.7352 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0239 -1.7548 -0.4922 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7054 -0.4669 0.2672 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3216 -2.1384 -0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7121 -1.5516 0.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2901 0.8275 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0395 -0.7258 0.5921 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2165 1.8722 -0.0304 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5499 1.6187 0.2934 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9602 0.3221 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2101 0.7323 -1.6916 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2349 -0.6298 -1.2356 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4677 -0.3023 2.3881 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3913 -1.2598 1.2231 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5943 1.3552 -1.7208 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6660 2.3301 -0.5829 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8395 1.6682 2.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8709 0.2988 2.4189 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4900 -0.0311 0.0791 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7579 1.6622 0.4935 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6594 -1.0200 1.2045 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2396 -1.5589 -0.3648 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0642 0.4915 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5483 0.9553 0.2205 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8225 -1.6519 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3301 -1.1914 0.4489 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5309 1.5760 -0.9622 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -2.5328 -0.5456 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5247 -3.1833 0.0635 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3773 -1.7289 0.8365 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8944 2.8822 -0.2729 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9981 0.1217 0.8565 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9976 3.4644 0.0675 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 16 1 0 0 0 0 2 22 1 0 0 0 0 3 21 2 0 0 0 0 4 25 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 17 43 1 0 0 0 0 18 20 2 0 0 0 0 18 44 1 0 0 0 0 19 21 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 45 1 0 0 0 0 22 24 1 0 0 0 0 23 26 2 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 M END $$$$