B2O8NX -OEChem-04012114453D 43 46 0 1 0 0 0 0 0999 V2000 -1.0470 1.0197 1.9811 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2578 -3.3495 -1.9756 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.3021 -3.6539 -0.0868 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -1.9863 -1.3804 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2442 1.5530 2.3731 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1219 0.9084 2.9495 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8303 -0.4764 1.2043 N 0 0 1 0 0 0 0 0 0 0 0 0 -2.0817 -1.1569 0.8318 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1213 -0.5479 0.0543 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3911 -1.7625 -0.7219 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5706 -0.6688 0.4504 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8059 -1.8463 -0.2295 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6081 -0.1891 -0.3657 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8512 -1.2832 1.6711 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9491 -0.3347 0.0628 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8073 -2.7106 -0.9187 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6401 1.9973 0.6334 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3442 0.4317 -1.5974 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1699 -1.4264 2.0923 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 -0.9557 1.2945 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9867 0.1448 -0.7532 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8353 2.9999 0.0922 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9139 1.7688 0.1134 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3874 0.9024 -2.3953 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7061 0.7592 -1.9741 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3046 3.7742 -0.9689 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3833 2.5429 -0.9477 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5786 3.5457 -1.4889 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0507 0.3411 -0.5549 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.6946 -0.4675 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3518 -1.6074 -1.8034 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0677 -1.6786 2.3113 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3419 0.5583 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3883 -1.9084 3.0408 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2362 -1.0792 1.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 0.0434 -0.4441 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1616 3.1970 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5666 1.0080 0.5308 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1706 1.3771 -3.3479 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5178 1.1249 -2.5963 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6779 4.5543 -1.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3769 2.3680 -1.3498 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9444 4.1488 -2.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 1 17 1 0 0 0 0 2 16 1 0 0 0 0 3 16 1 0 0 0 0 4 16 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 13 1 0 0 0 0 11 14 2 0 0 0 0 12 16 1 0 0 0 0 13 15 1 0 0 0 0 13 18 2 0 0 0 0 14 19 1 0 0 0 0 14 32 1 0 0 0 0 15 20 1 0 0 0 0 15 21 2 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 18 24 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 25 1 0 0 0 0 21 36 1 0 0 0 0 22 26 1 0 0 0 0 22 37 1 0 0 0 0 23 27 2 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 26 28 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M END $$$$