B2IK1R -OEChem-04012113522D 31 32 0 1 0 0 0 0 0999 V2000 3.4030 -1.3960 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -0.5300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -2.2620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9043 0.8212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 1.3593 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.8960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 0.4087 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5309 -0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -1.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.8960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2364 1.5655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5471 2.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 0.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9917 -0.8107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9917 0.0187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 -1.7676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4846 -1.5099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.0160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.2240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8439 1.8207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1364 2.3234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7397 3.1053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9578 2.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.5160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 14 1 0 0 0 0 4 16 2 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 5 25 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 14 2 0 0 0 0 12 23 1 0 0 0 0 13 15 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 M END $$$$