B6TVY2 -OEChem-04022104522D 39 42 0 0 0 0 0 0 0999 V2000 8.9282 -1.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 -0.0808 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6882 1.4747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6882 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 0.9608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6810 2.0946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6810 -1.2146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1300 1.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 34 1 0 0 0 0 2 14 1 0 0 0 0 2 20 1 0 0 0 0 3 11 2 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 26 1 0 0 0 0 5 16 2 0 0 0 0 5 19 1 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 7 16 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 10 15 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 13 17 2 0 0 0 0 13 28 1 0 0 0 0 14 18 2 0 0 0 0 15 19 2 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 35 1 0 0 0 0 22 24 2 0 0 0 0 22 36 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$