LJOV25 -OEChem-05032301122D 53 55 0 1 0 0 0 0 0999 V2000 3.4030 -5.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -5.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -6.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1350 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9451 3.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3437 4.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3905 4.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 3.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3437 5.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9451 6.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 6.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3905 5.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 6.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 6.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0791 2.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4776 3.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 4 16 2 0 0 0 0 5 19 2 0 0 0 0 6 8 1 0 0 0 0 6 53 1 0 0 0 0 7 16 1 0 0 0 0 17 7 1 6 0 0 0 7 44 1 0 0 0 0 8 19 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 31 1 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 13 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 14 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 45 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 23 1 0 0 0 0 20 46 1 0 0 0 0 21 24 2 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 29 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 30 1 0 0 0 0 29 30 2 0 0 0 0 M END $$$$