L85HTF -OEChem-05022322222D 37 39 0 1 0 0 0 0 0999 V2000 4.6384 -3.5622 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7319 -0.0724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4803 2.9622 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3464 1.4622 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4803 -0.0378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2124 2.9622 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 -0.5824 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8833 -1.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7204 0.9275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6143 1.4622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6143 2.4622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8143 1.4414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4803 0.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7551 -2.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0231 -2.0923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7204 2.9968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8143 2.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7666 -3.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0347 -3.0922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9064 -3.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3464 2.4622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4122 -0.8862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3038 0.4480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4595 0.2113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6962 -0.6329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2786 1.1293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2884 -1.7561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4826 -1.7885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7275 3.6168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2786 2.7951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5014 -3.4084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9136 -4.2021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0173 -0.3478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9434 -0.3478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2124 3.5822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7493 2.6522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 7 2 1 6 0 0 0 2 9 1 0 0 0 0 3 12 1 0 0 0 0 3 22 2 0 0 0 0 4 14 2 0 0 0 0 4 22 1 0 0 0 0 5 14 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 22 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 23 1 0 0 0 0 8 15 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 12 2 0 0 0 0 10 14 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 13 27 1 0 0 0 0 15 19 1 0 0 0 0 15 28 1 0 0 0 0 16 20 2 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 M END $$$$