B9HWU7 -OEChem-04022107212D 41 43 0 1 0 0 0 0 0999 V2000 6.4378 -0.7084 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0811 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 1.0180 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -0.9711 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.0024 2.4334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9378 -1.5745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9378 0.1576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2927 0.0468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5656 -1.7084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5717 -0.2084 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.9820 -2.5132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4672 0.7861 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9890 0.1280 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4890 0.9940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6582 -0.6152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2103 1.4552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 0.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3038 -1.2084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1698 -0.7084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3038 -2.2084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0358 -1.2084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0358 -2.2084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1698 -2.7084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7456 3.1025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9820 -0.9037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5656 -1.7084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 0.5639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6514 0.6479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6806 1.5836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9226 1.2462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1566 -0.9796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9682 -1.1521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5389 0.9294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7852 1.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1698 -0.0884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7668 -2.5184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1698 -3.3284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1604 2.6417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2063 3.5174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3307 3.5632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1747 -3.1025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 10 1 0 0 0 0 1 18 1 0 0 0 0 2 17 1 0 0 0 0 3 17 1 0 0 0 0 4 17 1 0 0 0 0 5 16 1 0 0 0 0 5 24 1 0 0 0 0 8 25 2 0 0 0 0 9 26 2 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 11 22 1 0 0 0 0 11 26 1 0 0 0 0 11 41 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 1 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 1 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 23 2 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 M END $$$$