L0XEV9 -OEChem-05022323422D 42 45 0 0 0 0 0 0 0999 V2000 5.6104 -1.7349 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 -2.8282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -2.0098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -0.3918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9880 -0.3281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 -1.3282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9343 -1.6329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -0.2872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1220 0.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 -0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1220 -1.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9880 -1.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9343 -0.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5179 -0.8281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 -1.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2449 0.9271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5239 -1.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5771 1.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2234 1.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4194 -0.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8877 2.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5341 2.0838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9413 -0.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4413 -0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8662 2.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 -1.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5205 0.6468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7235 0.6468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0439 0.2545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6454 -0.4358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7235 -2.3031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5205 -2.3031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1379 -0.8281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9704 1.5436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6375 0.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8802 0.0812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4737 3.0834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1408 2.2117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1891 0.4407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0589 3.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6111 0.2791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 23 1 0 0 0 0 2 15 2 0 0 0 0 3 26 2 0 0 0 0 4 8 1 0 0 0 0 4 42 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 7 12 2 0 0 0 0 7 14 1 0 0 0 0 8 26 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 33 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 20 2 0 0 0 0 18 21 1 0 0 0 0 18 34 1 0 0 0 0 19 22 2 0 0 0 0 19 35 1 0 0 0 0 20 24 1 0 0 0 0 20 36 1 0 0 0 0 21 25 2 0 0 0 0 21 37 1 0 0 0 0 22 25 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$