B8U0JR -OEChem-04022106052D 41 43 0 0 0 0 0 0 0999 V2000 9.4081 -4.6284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.0406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.4594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.5406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 4.9594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.9594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.4594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.5406 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.5406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -3.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -4.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7901 -4.6284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0991 -5.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0991 -5.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 1.7694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 3.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -1.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.8394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 0.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2004 -4.4368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7347 -6.0810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4635 -6.0810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.1494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 5.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 27 1 0 0 0 0 2 13 2 0 0 0 0 3 20 1 0 0 0 0 3 40 1 0 0 0 0 4 22 2 0 0 0 0 5 24 1 0 0 0 0 5 41 1 0 0 0 0 6 24 2 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 7 29 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 35 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 10 16 2 0 0 0 0 11 15 2 0 0 0 0 11 18 1 0 0 0 0 12 28 1 0 0 0 0 14 19 2 0 0 0 0 14 30 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 16 19 1 0 0 0 0 16 32 1 0 0 0 0 17 20 2 0 0 0 0 17 24 1 0 0 0 0 18 21 2 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 25 2 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 26 27 2 0 0 0 0 26 38 1 0 0 0 0 27 39 1 0 0 0 0 M END $$$$