BQW0B2 -OEChem-04012113113D 29 31 0 0 0 0 0 0 0999 V2000 -2.3846 -0.4026 -1.2139 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3196 0.3470 -1.1080 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3174 1.9397 0.2059 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0373 1.8243 0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3282 -0.4558 -0.0175 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9023 -0.1631 0.0795 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9712 0.7855 -0.0294 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7317 1.3278 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1209 -1.0185 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0562 -1.6282 -0.0917 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3444 0.9062 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5467 -0.6559 0.2227 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4491 -1.5289 -0.1781 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 -0.2740 -0.1892 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2535 -0.5049 1.3498 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5979 -0.1521 1.0368 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8062 -0.0622 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5605 -0.2841 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2903 2.8053 0.0608 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0756 -2.0883 0.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5761 -2.6004 -0.0842 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8342 1.8731 -0.1225 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0493 -2.4332 -0.2378 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1704 -0.2256 -0.2571 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8715 -0.6276 2.3551 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3535 0.0294 1.7904 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5496 -0.2145 -0.3949 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5651 0.3148 0.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3635 -1.3318 0.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 17 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 8 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 2 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 11 2 0 0 0 0 9 12 1 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 14 1 0 0 0 0 11 22 1 0 0 0 0 12 15 2 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 M END $$$$