BME3S2 -OEChem-04022103382D 36 38 0 0 0 0 0 0 0999 V2000 4.7438 -2.0494 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8484 0.9452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 -3.9798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7144 -0.5548 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -3.2753 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5804 1.9452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4464 2.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5804 0.9452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4464 3.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7144 2.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3404 1.9105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5804 3.9452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7144 0.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7144 3.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3404 3.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2464 2.4244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2464 3.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8484 -1.0548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9348 -0.6481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7657 -2.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2657 -1.3912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -3.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7925 0.3626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 1.0528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1774 2.1352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3332 1.2906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5804 4.5652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1774 3.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3332 4.5998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7822 2.1123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7822 3.7780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2513 -0.8648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8059 -0.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6491 -1.3264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1122 -3.8417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 20 1 0 0 0 0 2 13 2 0 0 0 0 3 22 2 0 0 0 0 4 13 1 0 0 0 0 4 18 1 0 0 0 0 4 32 1 0 0 0 0 5 22 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 7 9 1 0 0 0 0 7 11 2 0 0 0 0 8 13 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 12 1 0 0 0 0 9 15 2 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 16 1 0 0 0 0 11 26 1 0 0 0 0 12 14 2 0 0 0 0 12 27 1 0 0 0 0 14 28 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 19 21 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 34 1 0 0 0 0 M END $$$$