BF3U8K -OEChem-04022113033D 29 30 0 1 0 0 0 0 0999 V2000 -4.0781 -2.3694 0.3524 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0791 0.9590 0.2263 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6203 -1.2032 -0.3569 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3419 0.2973 0.2959 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0874 -1.0384 -0.4026 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1926 -0.0274 -0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3791 1.1343 -0.3722 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1882 0.4171 0.0764 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1712 -0.4667 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6121 -0.1720 -0.0657 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0599 1.1474 -0.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5284 -1.2127 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4378 1.6568 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 1.4262 -0.0443 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8924 -0.9340 0.1727 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3401 0.3855 0.1074 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5643 0.1726 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3772 -0.9994 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2525 1.3473 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3612 1.4450 0.3705 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9354 -1.4942 -0.4255 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6326 -3.3554 -0.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3841 1.9866 -0.2669 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1977 -2.2471 0.1399 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1522 2.2668 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6113 1.4876 1.3129 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7736 2.4530 -0.0993 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 -1.7441 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4022 0.6025 0.1738 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 22 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 3 5 1 0 0 0 0 3 6 2 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 17 1 0 0 0 0 5 18 1 0 0 0 0 6 8 1 0 0 0 0 7 13 2 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 14 1 0 0 0 0 11 23 1 0 0 0 0 12 15 2 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 16 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 M END $$$$