B90WLM -OEChem-04012119522D 28 27 0 1 0 0 0 0 0999 V2000 3.4030 -0.4050 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.0950 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1350 1.5950 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2690 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 1.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -0.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 0.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3249 -1.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9264 -2.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9169 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1569 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 13 1 0 0 0 0 2 11 1 0 0 0 0 2 24 1 0 0 0 0 3 12 1 0 0 0 0 3 28 1 0 0 0 0 4 11 2 0 0 0 0 5 12 2 0 0 0 0 6 13 2 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 16 1 0 0 0 0 9 12 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 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 M END $$$$