B6MDZ5 -OEChem-04012116422D 43 45 0 1 0 0 0 0 0999 V2000 2.0000 -2.9759 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.4759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4530 2.2793 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 1.3288 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7260 0.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 -0.2806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4315 2.4856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.9759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.9759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7422 3.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.9759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0529 4.3866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7049 1.7682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1868 0.1094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1868 0.9388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8913 -0.8476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6798 -0.5899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 2.7408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.1441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -0.2859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 1.3341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4521 1.8659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0454 2.3982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -1.3933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -2.0836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -3.5585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -2.8683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.3559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.7859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.7859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2455 4.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 9 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 11 2 0 0 0 0 10 12 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 13 17 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 23 3 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 19 21 2 0 0 0 0 19 40 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 M END $$$$