B3J1SK -OEChem-04022113573D 22 23 0 1 0 0 0 0 0999 V2000 -1.1449 1.5092 0.0516 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4974 -1.0677 0.3465 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6616 0.0665 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7363 0.2251 -0.3288 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6548 1.2659 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3045 0.6254 0.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2474 -1.7041 -0.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -0.7397 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1247 0.7362 0.0486 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -1.0573 -0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0766 0.0716 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5011 0.0689 0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7205 0.0632 -1.4155 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7053 2.1154 -0.6432 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8301 1.6475 1.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0429 -2.5700 0.5313 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3639 -2.0659 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2755 -1.7013 0.1642 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 0.8911 1.1295 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3312 1.6909 -0.4471 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9021 0.0279 -0.2588 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6793 -2.0661 -0.0882 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 11 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 2 18 1 0 0 0 0 3 12 3 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 8 2 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 10 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 M END $$$$