LJU1S9 -OEChem-05032301132D 53 54 0 1 0 0 0 0 0999 V2000 3.4030 4.3100 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -3.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -3.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -3.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.8100 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0010 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 1.8350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 1.8350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 3.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 4.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1225 -0.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5210 -0.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3437 0.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9451 1.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2097 -0.7977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8112 -0.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1191 -0.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7206 -0.7977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5072 -0.7269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8872 0.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 -3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 3 18 1 0 0 0 0 3 23 1 0 0 0 0 4 19 1 0 0 0 0 4 49 1 0 0 0 0 5 19 2 0 0 0 0 6 24 1 0 0 0 0 6 28 2 0 0 0 0 7 26 2 0 0 0 0 7 28 1 0 0 0 0 8 26 1 0 0 0 0 8 50 1 0 0 0 0 8 51 1 0 0 0 0 9 28 1 0 0 0 0 9 52 1 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 14 1 6 0 0 0 11 19 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 20 2 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 21 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 20 22 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 25 27 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END $$$$