BJN29V -OEChem-04012115152D 30 32 0 0 0 0 0 0 0999 V2000 3.4782 -2.6433 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3037 -0.9040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3037 2.6065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.6488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 2.8512 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5827 1.3512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5766 0.8512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 1.8512 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3147 0.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -0.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9930 0.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9930 1.6560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -1.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -1.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2366 0.4338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8381 -0.2564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.7688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.4712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1966 0.8512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 -0.6356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -1.9204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 -3.4176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 22 1 0 0 0 0 2 16 2 0 0 0 0 3 17 2 0 0 0 0 4 18 2 0 0 0 0 5 8 1 0 0 0 0 6 8 2 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 7 27 1 0 0 0 0 8 14 1 0 0 0 0 9 12 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 11 15 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 15 26 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 30 1 0 0 0 0 M CHG 2 5 -1 8 1 M END $$$$