B3EUA7 -OEChem-04012116222D 31 33 0 0 0 0 0 0 0999 V2000 5.3667 2.4101 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2277 1.3545 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8265 2.3726 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 3.6972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0544 2.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6454 0.6500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 -0.3010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0576 1.4590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6454 0.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1454 -0.8888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9544 -0.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1454 -1.8888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0576 1.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2332 1.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2794 -2.3888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0114 -2.3888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7486 2.4101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2794 -3.3888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0114 -3.3888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5576 2.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1454 -3.8888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7976 2.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5441 -0.4926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6166 1.5238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7425 -2.0788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5484 -2.0788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7425 -3.6988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5484 -3.6988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5576 3.6179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1454 -4.5088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.8888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 20 1 0 0 0 0 2 14 1 0 0 0 0 3 14 1 0 0 0 0 4 22 1 0 0 0 0 4 31 1 0 0 0 0 5 22 2 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 13 1 0 0 0 0 7 10 2 0 0 0 0 8 13 2 0 0 0 0 8 17 1 0 0 0 0 9 11 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 23 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 14 24 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 16 19 2 0 0 0 0 16 26 1 0 0 0 0 17 20 2 0 0 0 0 17 22 1 0 0 0 0 18 21 2 0 0 0 0 18 27 1 0 0 0 0 19 21 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 21 30 1 0 0 0 0 M END $$$$