L2TIR3 -OEChem-05022323252D 43 46 0 0 0 0 0 0 0999 V2000 6.3246 -1.0366 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2301 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 0.4472 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.9424 -5.1705 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3546 -5.0941 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -3.7584 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -3.2695 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2531 4.5812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 4.0431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.5747 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.7699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.9853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -2.5252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -2.7314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -3.6819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 1.1916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 -1.9871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -3.8881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 2.1421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 2.6801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 2.8864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 -4.4262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 -2.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 -3.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 3.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.5799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 1.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4492 -4.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8848 2.2699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 3.1416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0279 -1.7318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5311 -3.2717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4457 5.1705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 17 1 0 0 0 0 3 23 1 0 0 0 0 4 30 1 0 0 0 0 5 30 1 0 0 0 0 6 30 1 0 0 0 0 7 16 2 0 0 0 0 8 33 1 0 0 0 0 8 43 1 0 0 0 0 9 33 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 23 2 0 0 0 0 15 24 1 0 0 0 0 16 19 1 0 0 0 0 17 21 2 0 0 0 0 18 22 2 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 26 1 0 0 0 0 20 30 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 27 1 0 0 0 0 24 28 2 0 0 0 0 24 37 1 0 0 0 0 25 31 2 0 0 0 0 26 32 2 0 0 0 0 26 38 1 0 0 0 0 27 29 2 0 0 0 0 27 39 1 0 0 0 0 28 29 1 0 0 0 0 28 40 1 0 0 0 0 29 33 1 0 0 0 0 31 32 1 0 0 0 0 31 41 1 0 0 0 0 32 42 1 0 0 0 0 M END $$$$