BET09R -OEChem-04022109583D 55 58 0 1 0 0 0 0 0999 V2000 4.6902 1.6406 -0.1343 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5645 -2.1192 0.0731 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8518 -0.2259 -1.1388 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3667 0.8311 -0.4582 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2551 -0.1075 1.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1122 1.8295 0.4029 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2848 1.0835 -1.7745 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9289 0.5823 2.1275 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7059 -0.7101 1.3265 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3968 0.8104 2.5818 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7132 -0.9578 0.8805 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7418 -1.6609 -0.3856 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3381 -1.4167 0.0551 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7431 -0.5568 0.0469 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4051 0.9300 1.5192 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5875 -1.6713 1.7005 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1514 -0.4738 -0.3521 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -1.9008 1.2878 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4638 -0.7032 -0.7647 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6658 1.9934 0.6912 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1538 -0.9165 -0.4071 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9873 0.3698 0.2521 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1066 3.3391 0.5241 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0623 -0.2581 -0.4762 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8381 2.8281 -0.4412 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 2.3750 -1.7637 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4499 -1.5607 -0.1621 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7144 0.4372 -1.4944 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4897 -2.1680 -0.8662 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 -0.1700 -2.1986 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1417 -1.4726 -1.8845 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2897 0.5701 3.0194 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6041 1.4400 1.5244 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3514 -0.7098 0.4386 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0444 -1.5663 1.9251 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4219 1.7172 3.1996 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6774 -0.0125 3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0709 -2.6349 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7666 -1.7732 -1.4786 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7587 -0.4497 1.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2582 -2.0510 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4794 0.0832 -0.9996 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 -2.4554 1.9369 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7842 -0.3295 -1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9045 4.0836 0.4421 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4967 3.3884 -0.3831 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 3.6167 1.3735 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5834 3.8050 -0.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7924 2.9022 -2.6937 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -2.1218 0.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4417 1.4531 -1.7687 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4683 -2.3458 -0.2335 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7917 -3.1822 -0.6219 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2622 0.3710 -2.9916 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9512 -1.9454 -2.4329 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 22 1 0 0 0 0 2 21 1 0 0 0 0 2 52 1 0 0 0 0 3 21 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 14 1 0 0 0 0 5 15 1 0 0 0 0 5 22 2 0 0 0 0 6 25 2 0 0 0 0 7 26 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 15 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 21 1 0 0 0 0 14 40 1 0 0 0 0 15 20 2 0 0 0 0 16 18 1 0 0 0 0 16 41 1 0 0 0 0 17 19 2 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 20 23 1 0 0 0 0 22 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 27 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 29 1 0 0 0 0 27 50 1 0 0 0 0 28 30 2 0 0 0 0 28 51 1 0 0 0 0 29 31 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 M END $$$$