B4YXI5 -OEChem-04012118002D 36 38 0 0 0 0 0 0 0999 V2000 7.3058 4.4372 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 4.3971 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.1272 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.1272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -3.1272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 2.4373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7484 0.9074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -0.0925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -2.1619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -1.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -0.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -0.6064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -1.6480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 2.4173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6086 1.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4572 2.9273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7253 2.9073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4456 3.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7137 3.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5739 4.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7528 -2.7818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.4928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -1.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -0.3172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2018 -0.2943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2018 -1.9601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1491 1.1136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 2.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 -4.4372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5667 5.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8623 2.7535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 2 0 0 0 0 3 11 1 0 0 0 0 4 34 1 0 0 0 0 7 21 1 0 0 0 0 7 36 1 0 0 0 0 8 12 1 0 0 0 0 8 20 2 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 12 17 2 0 0 0 0 13 18 2 0 0 0 0 13 26 1 0 0 0 0 14 16 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 32 1 0 0 0 0 21 23 1 0 0 0 0 22 24 2 0 0 0 0 22 33 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 25 35 1 0 0 0 0 M END $$$$