B4ETX5 -OEChem-04022100342D 52 56 0 1 0 0 0 0 0999 V2000 6.0149 2.3143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1988 -0.3445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2092 2.8965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0494 -0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1226 0.5578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7059 0.0606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8867 -2.4591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5331 1.6036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4544 2.6205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5149 0.7754 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7059 1.3632 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9032 0.7768 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2053 -0.1692 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3239 1.3632 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0149 2.3143 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2112 -0.1683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7118 1.3658 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4681 -0.7486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9516 1.0842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7937 0.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7878 0.9368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8159 -1.4616 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4054 2.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6442 0.1326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5754 2.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5278 -0.3564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 -2.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4653 0.3379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1509 -0.7868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2057 2.9042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6048 -0.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2758 -0.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0996 1.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8584 -0.6360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2645 -1.3342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2964 -1.8001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1906 1.9816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 1.5822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8094 0.8016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0542 0.3232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4536 -0.4574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2342 -0.0579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1498 2.2440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3421 2.5852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0009 1.7775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -0.6076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -0.9233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0946 -0.1052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5147 -3.4540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3435 -3.1677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0572 -2.3390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14 1 1 1 0 0 0 1 15 1 0 0 0 0 2 13 1 0 0 0 0 2 20 1 0 0 0 0 3 15 1 0 0 0 0 3 23 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 17 5 1 1 0 0 0 5 27 1 0 0 0 0 6 20 2 0 0 0 0 7 22 1 0 0 0 0 7 28 1 0 0 0 0 8 21 2 0 0 0 0 9 23 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 18 1 1 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 17 1 0 0 0 0 12 16 1 0 0 0 0 12 19 1 0 0 0 0 12 29 1 0 0 0 0 13 16 1 0 0 0 0 13 30 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 23 1 0 0 0 0 17 34 1 0 0 0 0 18 22 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 24 1 0 0 0 0 19 25 1 0 0 0 0 19 26 1 0 0 0 0 22 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END $$$$