LB3J4R -OEChem-05032300202D 43 45 0 1 0 0 0 0 0999 V2000 2.1521 -2.5610 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.6964 -4.3658 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9856 -1.5996 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 2.0000 2.6600 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6213 4.5610 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.9641 -1.3934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1918 -2.5781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3607 -1.2677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6499 -0.1110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0071 -1.8058 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6964 -2.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7502 -3.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3392 -1.0615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7502 -4.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2800 -3.5610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7794 -0.6211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 -2.5610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 -4.5610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0181 -3.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0181 -4.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 0.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2927 1.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6249 2.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 2.1219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9355 3.2787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9785 2.8662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2677 4.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2892 3.8168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1997 -1.2165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -3.5610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 -0.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -0.0144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1727 -0.7489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 -1.9410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 -5.1810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2566 0.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3781 -1.8548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4812 -4.3710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3754 0.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8994 1.7117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4537 1.5326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5422 3.4065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4603 4.6123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 6 1 0 0 0 0 3 7 2 0 0 0 0 3 10 1 0 0 0 0 3 16 1 0 0 0 0 4 26 1 0 0 0 0 5 28 1 0 0 0 0 6 37 1 0 0 0 0 8 13 2 0 0 0 0 9 13 1 0 0 0 0 9 21 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 1 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 14 2 0 0 0 0 12 17 1 0 0 0 0 14 18 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 24 41 1 0 0 0 0 25 27 2 0 0 0 0 25 42 1 0 0 0 0 26 28 2 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 M END $$$$