D05UMA -OEChem-10101305022D 40 42 0 1 0 0 0 0 0999 V2000 4.6551 -2.0857 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4979 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 -2.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 0.9674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 3.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -3.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -3.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.4813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 2.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 0.4770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 0.4770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -0.9729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -0.9729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8628 -1.8941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 1.1921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0829 0.3475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.6221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 2.8121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0829 3.6567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3285 -3.5383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5997 -3.5383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.8079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 1.1692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 2.8350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 18 1 0 0 0 0 4 2 1 1 0 0 0 2 8 1 0 0 0 0 3 6 1 0 0 0 0 3 19 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 14 1 0 0 0 0 10 16 2 0 0 0 0 11 17 1 0 0 0 0 11 27 1 0 0 0 0 12 15 1 0 0 0 0 12 29 1 0 0 0 0 13 20 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 16 21 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 M END $$$$