B9DI5C -OEChem-04022108213D 42 44 0 0 0 0 0 0 0999 V2000 3.7160 1.6989 -0.7775 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5017 -0.0115 1.5748 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1893 1.2874 -1.3523 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3217 1.3557 1.1078 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9486 2.2137 -1.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9042 2.4967 0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9174 -0.3213 0.3991 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1733 -2.0718 -1.4029 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1633 -1.6085 -0.9281 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6143 0.1980 -0.1806 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3352 -1.5129 -0.6071 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6511 -0.7382 -0.0451 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3655 -0.2582 -0.6272 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8862 1.6125 0.1516 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2043 -2.5224 -0.7874 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4514 -2.0896 -0.3453 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9142 -0.3217 -1.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9854 0.1912 -0.2742 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7911 -2.2088 0.4979 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4593 -0.4959 0.8433 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1115 1.9667 0.5727 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8622 -1.6959 1.2295 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2163 0.9841 0.7195 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7949 2.6344 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9172 -0.7826 2.7004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2349 -3.1684 -1.3819 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2858 -1.8007 -2.4614 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5641 0.4586 -0.7615 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0594 -3.5740 -1.0197 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2588 -2.8092 -0.2385 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5408 0.1905 -1.8873 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3301 -3.1429 0.8056 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6475 -1.0224 0.4868 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3473 2.9958 0.8253 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1738 -2.2849 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9467 2.3878 0.6626 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1357 3.6365 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4456 2.6952 -1.0213 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1856 0.6836 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2938 -1.7663 2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 -0.8492 3.4581 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7556 -0.2505 3.1622 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 18 1 0 0 0 0 2 20 1 0 0 0 0 2 25 1 0 0 0 0 3 39 1 0 0 0 0 4 23 2 0 0 0 0 7 12 1 0 0 0 0 7 23 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 13 2 0 0 0 0 9 15 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 11 17 2 0 0 0 0 11 19 1 0 0 0 0 12 16 1 0 0 0 0 13 28 1 0 0 0 0 14 21 2 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 20 2 0 0 0 0 19 22 2 0 0 0 0 19 32 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$