B5S7UO -OEChem-04012120012D 31 29 0 1 0 0 0 0 0999 V2000 6.8671 -2.1550 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 4.2690 2.3450 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 5.7690 3.2110 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 8.3671 -1.2890 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 6.8671 -3.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 -2.1550 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.7690 3.2110 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.8671 -2.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 1.4790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.3450 0.0000 C 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 0.3450 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 3.4030 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4776 -1.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0791 -0.5724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 1.7373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 2.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 7 1 0 0 0 0 1 9 2 0 0 0 0 1 15 1 0 0 0 0 2 6 1 0 0 0 0 2 8 1 0 0 0 0 2 10 2 0 0 0 0 2 16 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 11 21 1 0 0 0 0 11 31 1 0 0 0 0 12 21 2 0 0 0 0 13 15 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 14 19 2 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 18 20 2 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 4 3 1 4 1 7 -1 8 -1 M END $$$$