B1M6FY -OEChem-04012112452D 39 41 0 0 0 0 0 0 0999 V2000 4.1701 2.2694 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6299 -1.2132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9791 2.8572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3611 1.6816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8408 -3.3010 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7069 -1.8010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7069 -2.8010 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7469 1.6695 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4389 -1.8010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4389 -2.8010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9389 -0.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 3.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7579 1.4604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 0.5469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2479 -1.2132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9389 -0.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5729 -3.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 -3.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 3.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 2.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5729 -4.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 -4.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4389 -4.8010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 4.8010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.7829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 4.6965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7524 1.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7345 0.4821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8376 -1.4048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3034 0.2394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8419 -2.9910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6056 4.0568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 2.4075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -4.6110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8419 -4.6110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4389 -5.4210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 5.3674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 3.7181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 5.1981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 5 7 1 0 0 0 0 6 7 2 0 0 0 0 7 17 1 0 0 0 0 8 27 3 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 10 17 1 0 0 0 0 10 18 2 0 0 0 0 11 14 1 0 0 0 0 11 16 2 0 0 0 0 12 19 2 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 21 2 0 0 0 0 18 22 1 0 0 0 0 18 31 1 0 0 0 0 19 24 1 0 0 0 0 19 32 1 0 0 0 0 20 25 2 0 0 0 0 20 33 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 24 26 2 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M CHG 2 5 -1 7 1 M END $$$$