BN76QZ -OEChem-04042106213D 40 43 0 1 0 0 0 0 0999 V2000 -8.3528 -1.1038 0.0731 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.9536 0.6221 -0.2101 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8242 -0.1120 1.6782 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9503 0.5931 2.5331 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0092 2.7285 -0.4053 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1418 -2.3852 -1.3427 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4397 2.0883 -0.4566 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5619 -1.3722 0.7021 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -3.6585 0.2855 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9512 0.3338 0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7765 0.0126 -0.9896 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7752 -1.2040 -1.8560 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0434 -0.7921 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9538 -0.0201 0.2745 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7113 0.7898 0.0342 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7236 0.6252 1.4297 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6486 -2.3992 -0.0708 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4579 0.1876 0.1432 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8091 2.1410 -0.2979 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6975 0.9362 -0.0801 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6536 2.8900 -0.5211 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5996 2.2876 -0.4122 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2097 0.9210 -0.1593 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3701 0.0055 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3746 -1.3378 0.3047 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6956 -1.8678 0.3676 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6504 -0.9094 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8101 0.9717 -1.4922 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -1.0520 -2.9281 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8328 -0.3642 -1.7665 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -1.4024 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0518 1.6527 1.2596 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3312 -0.8596 0.4001 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8621 -3.8480 1.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3414 -4.4392 -0.3559 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7318 3.9419 -0.7797 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4453 2.9337 -0.5999 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9199 -0.6519 0.2712 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4922 -1.9388 0.4793 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9271 -2.9015 0.5917 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 24 1 0 0 0 0 2 27 1 0 0 0 0 3 16 1 0 0 0 0 4 16 1 0 0 0 0 5 19 1 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 7 23 2 0 0 0 0 8 14 1 0 0 0 0 8 17 2 0 0 0 0 9 17 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 20 1 0 0 0 0 10 23 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 15 19 2 0 0 0 0 16 32 1 0 0 0 0 18 20 2 0 0 0 0 18 33 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 M END $$$$