L8LU4B -OEChem-05022323082D 53 56 0 1 0 0 0 0 0999 V2000 5.4718 -0.0945 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6019 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9751 -0.9624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9684 0.7735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8699 -0.5670 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.8699 1.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3397 -0.5911 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8699 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3699 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3699 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7359 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0038 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7359 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7359 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2359 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0038 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1099 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1099 1.4677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2038 -0.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8699 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2038 0.9538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6038 0.4022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7398 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 1.4022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 0.3955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 1.3955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4687 -1.4065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7872 -2.2210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2622 -3.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4775 -3.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9525 -2.2210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7359 -0.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3559 -0.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7359 0.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6989 -1.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5459 -1.4700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7728 -0.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1171 -1.2216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1171 2.0876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4899 2.4330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8699 3.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2499 2.4330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6681 1.2659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3421 -1.2111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7421 -0.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1357 1.7142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3361 0.0834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7296 2.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 2.4303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 2.2001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 1.3540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 22 1 0 0 0 0 2 13 2 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 13 1 0 0 0 0 6 16 1 0 0 0 0 6 20 1 0 0 0 0 7 19 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 18 1 0 0 0 0 17 19 2 0 0 0 0 17 40 1 0 0 0 0 18 21 2 0 0 0 0 18 41 1 0 0 0 0 19 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 47 1 0 0 0 0 24 26 2 0 0 0 0 24 48 1 0 0 0 0 25 27 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END $$$$