BXJ68T -OEChem-04012114052D 44 47 0 1 0 0 0 0 0999 V2000 11.1378 -2.5245 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7214 -1.7198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6166 3.6549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6448 -1.0173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -1.2252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1378 -0.9150 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8259 0.7052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5935 -2.7198 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4595 -2.2198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7275 -2.2198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5935 -3.7198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3256 -2.7198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4595 -1.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1916 -2.2198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8139 -2.6265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1916 -1.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3256 -0.7197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1448 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2381 -0.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4246 1.7233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2436 0.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7214 -1.7198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0179 2.6369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8368 0.9143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4191 1.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0233 2.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1304 -3.0298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9735 -3.7198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5935 -4.3398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2135 -3.7198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3256 -3.3398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9226 -0.9097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 -3.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3256 -0.0997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5282 -1.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3304 -0.3257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8791 -0.5008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6194 2.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9746 3.2554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2202 0.9791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7836 2.1204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4218 2.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0666 2.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.7198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 22 1 0 0 0 0 2 22 2 0 0 0 0 3 26 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 10 2 0 0 0 0 6 16 1 0 0 0 0 6 22 1 0 0 0 0 6 36 1 0 0 0 0 7 19 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 6 0 0 0 8 27 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 15 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 17 2 0 0 0 0 13 32 1 0 0 0 0 14 16 2 0 0 0 0 15 18 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 21 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 20 25 2 0 0 0 0 21 24 2 0 0 0 0 21 37 1 0 0 0 0 23 26 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END $$$$