BL6E3W -OEChem-04012113092D 27 26 0 1 0 0 0 0 0999 V2000 4.2690 -2.3450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.1550 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2690 -0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 0.5724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 1.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0569 1.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6584 0.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 -0.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0739 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 12 1 0 0 0 0 2 24 1 0 0 0 0 3 12 2 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 4 21 1 0 0 0 0 10 5 1 6 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 M END $$$$