B2SEM0 -OEChem-04012114312D 48 49 0 1 0 0 0 0 0999 V2000 6.8909 -3.2445 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 8.4732 -3.9489 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 5.0298 -0.7799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4608 -0.4709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -2.5400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3031 -2.4354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9529 0.8079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4888 0.8079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4787 -4.0535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6999 -2.6567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0819 -3.8322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4677 -3.8444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5778 -4.9435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3687 -2.9544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 0.8079 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 2.3079 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4118 -0.7799 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7208 -1.7310 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2208 -0.1921 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7208 -1.7310 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3086 -2.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 1.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3548 1.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 2.8079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3548 2.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2208 3.8079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3548 4.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3548 5.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9734 -1.2183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1085 -1.6340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6684 0.0894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3332 -1.6340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7514 -2.8118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4795 -3.1359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3852 -3.1064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6238 2.6179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8179 2.6179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8314 3.7002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4329 4.3905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7442 4.4156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1428 3.7253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9748 5.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3548 5.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7348 5.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6351 -2.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8322 -4.3460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0762 -5.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 1 11 2 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 2 14 2 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 17 4 1 1 0 0 0 4 35 1 0 0 0 0 18 5 1 1 0 0 0 5 36 1 0 0 0 0 6 21 1 0 0 0 0 7 22 2 0 0 0 0 8 23 2 0 0 0 0 10 46 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 19 15 1 6 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 16 22 1 0 0 0 0 16 24 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 18 20 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 6 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 23 25 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 38 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 M END $$$$