L3XET4 -OEChem-05032301012D 57 60 0 0 0 0 0 0 0999 V2000 12.1304 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9343 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5381 2.5242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9343 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9343 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3984 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9343 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3083 2.5347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 2.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 0.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1304 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9965 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5449 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1463 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3237 -1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7222 -2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9998 1.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7969 1.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5313 -0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6629 2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8659 2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3154 -0.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0693 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2634 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3154 3.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8665 0.6671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2634 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 -1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6663 -4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0693 -2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3065 1.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5334 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6865 3.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0693 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5405 3.1441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 2 0 0 0 0 2 6 1 0 0 0 0 2 8 1 0 0 0 0 2 38 1 0 0 0 0 3 6 2 0 0 0 0 3 14 1 0 0 0 0 4 13 1 0 0 0 0 4 14 2 0 0 0 0 5 23 1 0 0 0 0 5 56 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 7 13 2 0 0 0 0 7 18 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 15 2 0 0 0 0 9 19 1 0 0 0 0 10 17 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 16 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 20 2 0 0 0 0 13 21 1 0 0 0 0 15 39 1 0 0 0 0 16 27 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 25 2 0 0 0 0 17 26 1 0 0 0 0 18 24 2 0 0 0 0 18 42 1 0 0 0 0 19 22 2 0 0 0 0 19 43 1 0 0 0 0 20 22 1 0 0 0 0 20 44 1 0 0 0 0 21 23 2 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 25 28 1 0 0 0 0 25 48 1 0 0 0 0 26 29 2 0 0 0 0 26 49 1 0 0 0 0 27 30 1 0 0 0 0 28 31 2 0 0 0 0 28 50 1 0 0 0 0 29 31 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 M END $$$$