B0ZYR7 -OEChem-04012118522D 42 44 0 1 0 0 0 0 0999 V2000 2.0000 -2.4263 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3165 1.7687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8717 0.4343 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9698 1.2525 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 0.0788 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3991 -0.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 -0.1535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3717 -1.1046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0772 -1.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0567 -1.8893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3717 -1.1046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9942 1.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0627 -0.1535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6868 -1.8893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0473 0.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2678 2.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6475 0.5172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6663 -1.6806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3444 -0.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2435 2.4263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6232 0.7364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3014 0.2135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9473 -0.9796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7783 -0.1994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0957 -2.3003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6910 -1.7684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5267 -2.2111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -2.4665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8717 1.0543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8852 -2.4767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8626 0.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2390 2.8264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6529 2.2863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1256 0.1826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8864 -0.0550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7384 -0.5587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3794 1.8214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8484 2.5622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1076 3.0312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7591 0.1315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2281 0.8723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4873 1.3413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 12 2 0 0 0 0 3 7 1 0 0 0 0 3 13 1 0 0 0 0 3 29 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 22 1 0 0 0 0 6 9 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 13 15 1 0 0 0 0 14 18 2 0 0 0 0 14 30 1 0 0 0 0 15 19 2 0 0 0 0 15 31 1 0 0 0 0 16 20 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 21 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 M END $$$$