BU1N0Q -OEChem-04012112142D 27 27 0 1 0 0 0 0 0999 V2000 5.6412 -1.3524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4608 0.3460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6197 1.6331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0081 0.9129 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3034 -1.0131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 0.2949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8034 0.5257 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8002 -0.0652 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5434 -0.7344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4944 -0.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8492 -0.3743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8034 0.5257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 -0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1124 -0.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4118 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3899 0.1264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0548 -1.1161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8344 -1.2818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5474 1.3278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5978 1.1045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2349 0.9013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3034 -1.6331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 1.0273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6664 -0.3959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 -0.5616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7021 -0.6169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 15 1 0 0 0 0 2 27 1 0 0 0 0 3 15 2 0 0 0 0 8 4 1 1 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 5 22 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 6 21 1 0 0 0 0 7 12 1 0 0 0 0 7 14 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 12 2 0 0 0 0 12 23 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 M END $$$$