LLUX92 -OEChem-05032301312D 90 92 0 1 0 0 0 0 0999 V2000 14.0507 -0.0201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -4.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -4.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5119 -1.7414 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -1.4050 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0632 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -1.4050 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.0338 -2.3995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0119 -2.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8428 -0.9983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.9050 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7331 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.5950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7331 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -5.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -5.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 4.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 4.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 5.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 5.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 5.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4093 -1.7427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4617 -0.4301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6647 -0.4301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4138 -2.3995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9690 -3.0161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8203 -3.1971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5783 -2.8596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5866 -2.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9851 -2.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1285 -1.6766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6738 -3.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2753 -2.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5210 -0.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1225 -1.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 0.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8112 1.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2097 2.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3187 -5.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7172 -5.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5244 2.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 1.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4853 -6.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3322 -6.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1053 -5.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 4.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 2.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 3.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 5.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 4.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 5.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 2 0 0 0 0 2 20 2 0 0 0 0 3 23 1 0 0 0 0 3 31 1 0 0 0 0 4 23 2 0 0 0 0 5 26 2 0 0 0 0 6 34 2 0 0 0 0 7 42 1 0 0 0 0 7 44 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 8 57 1 0 0 0 0 14 9 1 1 0 0 0 9 20 1 0 0 0 0 9 58 1 0 0 0 0 21 10 1 6 0 0 0 10 26 1 0 0 0 0 10 64 1 0 0 0 0 25 11 1 6 0 0 0 11 34 1 0 0 0 0 11 70 1 0 0 0 0 12 13 1 1 0 0 0 12 15 1 0 0 0 0 12 17 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 18 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 23 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 61 1 0 0 0 0 22 24 1 0 0 0 0 22 62 1 0 0 0 0 22 63 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 65 1 0 0 0 0 27 30 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 28 32 1 0 0 0 0 28 68 1 0 0 0 0 29 33 2 0 0 0 0 29 69 1 0 0 0 0 30 36 2 0 0 0 0 30 37 1 0 0 0 0 31 39 1 0 0 0 0 31 71 1 0 0 0 0 31 72 1 0 0 0 0 32 35 2 0 0 0 0 32 73 1 0 0 0 0 33 35 1 0 0 0 0 33 74 1 0 0 0 0 34 38 1 0 0 0 0 35 75 1 0 0 0 0 36 40 1 0 0 0 0 36 76 1 0 0 0 0 37 41 2 0 0 0 0 37 77 1 0 0 0 0 38 42 1 0 0 0 0 38 78 1 0 0 0 0 38 79 1 0 0 0 0 39 80 1 0 0 0 0 39 81 1 0 0 0 0 39 82 1 0 0 0 0 40 43 2 0 0 0 0 40 83 1 0 0 0 0 41 43 1 0 0 0 0 41 84 1 0 0 0 0 42 85 1 0 0 0 0 42 86 1 0 0 0 0 43 87 1 0 0 0 0 44 45 1 0 0 0 0 44 88 1 0 0 0 0 44 89 1 0 0 0 0 45 46 3 0 0 0 0 46 90 1 0 0 0 0 M END $$$$