B8ACZ7 -OEChem-04022110302D 38 38 0 1 0 0 0 0 0999 V2000 5.0929 1.0429 0.0000 S 0 3 3 0 0 0 0 0 0 0 0 0 6.8249 -2.9571 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0051 3.3907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1807 3.3907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 1.9908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8249 0.0429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8249 -1.9571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0929 -2.9571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8249 -3.9571 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.8249 -2.9571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8249 -2.9571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2839 1.6307 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5929 2.5817 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5929 2.5817 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9019 1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0929 0.0429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3328 1.3216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9589 -0.4571 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9589 -1.4571 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0929 -1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1869 1.0183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9805 2.4847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2052 2.4847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2119 1.0937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4683 1.8828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4823 0.1505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8808 -0.5397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8442 0.9399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6239 0.7742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4958 -0.7671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9589 -2.0771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2573 3.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7973 3.3259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8808 -1.3745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4823 -2.0648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3619 -0.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5559 -3.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 7 1 0 0 0 0 2 9 1 0 0 0 0 2 10 2 0 0 0 0 2 11 2 0 0 0 0 13 3 1 1 0 0 0 3 32 1 0 0 0 0 14 4 1 6 0 0 0 4 33 1 0 0 0 0 5 17 1 0 0 0 0 5 36 1 0 0 0 0 18 6 1 6 0 0 0 6 37 1 0 0 0 0 19 7 1 6 0 0 0 8 20 1 0 0 0 0 8 38 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 1 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 M CHG 2 1 1 9 -1 M END $$$$