BS5Z2G -OEChem-04042102003D 28 30 0 0 0 0 0 0 0999 V2000 -3.1435 -1.8903 -1.2441 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2161 -2.2346 1.3714 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4568 0.0288 0.4644 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2008 2.2801 -0.7805 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0158 -0.7489 -0.3938 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0954 0.0804 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3941 -0.5428 -0.1767 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3323 -0.4343 -0.3399 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4452 -1.8422 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0119 0.6166 -0.6455 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0818 1.2782 0.8158 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1407 -1.5046 0.5039 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3764 0.8142 -0.4338 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5404 0.2107 -0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5052 -1.3069 0.7157 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -0.1476 0.2468 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2785 1.9200 1.1456 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4937 1.3904 0.7356 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0018 2.0329 -0.9284 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8506 -2.6218 -1.5657 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4334 1.3660 -1.1825 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1434 1.7111 1.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6785 -2.4128 0.8834 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4964 -0.1969 -0.3259 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 2.8378 1.7264 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4191 1.8966 0.9967 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3479 2.7484 -1.4553 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7701 0.8622 0.0833 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 15 1 0 0 0 0 3 16 1 0 0 0 0 3 28 1 0 0 0 0 4 19 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 6 8 1 0 0 0 0 6 11 2 0 0 0 0 7 10 2 0 0 0 0 7 12 1 0 0 0 0 8 14 2 0 0 0 0 9 20 1 0 0 0 0 10 13 1 0 0 0 0 10 21 1 0 0 0 0 11 17 1 0 0 0 0 11 22 1 0 0 0 0 12 15 2 0 0 0 0 12 23 1 0 0 0 0 13 16 2 0 0 0 0 13 19 1 0 0 0 0 14 18 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 26 1 0 0 0 0 19 27 1 0 0 0 0 M END $$$$