L84WML -OEChem-05022322133D 31 31 0 0 0 0 0 0 0999 V2000 4.8388 -0.7466 0.2147 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9835 0.4224 -0.6287 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -1.6365 1.2528 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9389 -1.1221 -1.1826 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2148 -0.3492 0.5831 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5925 0.7809 0.4259 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6173 0.8314 -0.0882 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1371 0.7233 -0.2316 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5894 -0.1072 -1.2093 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2999 1.4528 0.6125 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6324 0.5215 -0.4988 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7953 -0.2082 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0848 1.3521 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7642 0.6034 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0045 -0.1642 0.4458 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0236 -0.7938 0.3604 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2645 -1.5600 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0524 0.9574 -1.0871 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8817 1.7265 0.4874 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2318 -0.6808 -1.8723 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7129 2.1068 1.3761 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9602 -0.4030 1.5788 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2163 -0.8571 -2.1061 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6996 1.9577 1.1382 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 1.1438 1.3841 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4107 1.5040 -0.2808 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2337 0.2504 1.4458 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9938 1.6686 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4062 -2.1935 1.1367 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2503 -2.2053 -0.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1282 -0.8930 0.1752 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 11 1 0 0 0 0 2 14 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 12 1 0 0 0 0 9 20 1 0 0 0 0 10 13 2 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 3 0 0 0 0 16 17 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 M END $$$$