LJZ10K -OEChem-05032301132D 43 47 0 1 0 0 0 0 0999 V2000 4.6783 2.8570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8497 -2.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.2630 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4053 1.1017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -1.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2619 -1.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8497 -0.6493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.6536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.2970 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8007 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8007 -1.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9352 0.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9352 1.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 1.9064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8012 0.1017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8012 2.1017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6672 0.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6672 1.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 -0.7009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1018 -0.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3127 -0.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1492 0.1651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4173 -1.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9296 -0.3518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9296 -2.5647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4173 -1.8935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6581 -2.8570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -2.8523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7853 1.1017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8012 -0.5183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8012 2.7217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.6483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.2683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2041 0.2917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2041 1.9117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 5 1 0 0 0 0 2 11 1 0 0 0 0 2 33 1 0 0 0 0 3 6 1 0 0 0 0 3 13 1 0 0 0 0 3 34 1 0 0 0 0 4 9 1 0 0 0 0 4 16 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 6 0 0 0 6 8 2 0 0 0 0 7 10 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 14 1 0 0 0 0 9 28 1 6 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 18 2 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 17 21 1 0 0 0 0 17 36 1 0 0 0 0 18 22 1 0 0 0 0 18 37 1 0 0 0 0 19 23 1 0 0 0 0 19 38 1 0 0 0 0 20 24 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 M END $$$$