D00228 -OEChem-05072121472D 26 27 0 1 0 0 0 0 0999 V2000 3.2320 -1.8123 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7265 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -0.8613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4131 -3.5349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7265 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2265 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.7265 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2735 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9230 -0.8613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -1.8123 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8198 -2.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.7265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2845 0.0080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -0.3244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3566 -1.1135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8444 -1.7154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3338 -2.9681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2505 -2.1754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.9165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7775 -4.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 4.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 15 1 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 4 12 1 0 0 0 0 4 24 1 0 0 0 0 5 14 2 0 0 0 0 9 6 1 1 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 7 14 1 0 0 0 0 7 16 2 0 0 0 0 8 16 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 1 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 13 15 2 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 M END $$$$