B90KJX -OEChem-04022103003D 45 47 0 0 0 0 0 0 0999 V2000 -0.6648 2.1086 -0.6798 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0383 -0.5962 -0.1168 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1687 0.7828 1.0325 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4737 0.7797 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6687 -0.6989 0.5869 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8175 1.5122 0.3131 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7747 -1.3315 -0.2604 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8851 0.8065 -0.5256 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4404 1.4299 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0975 -1.2425 -0.8916 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7989 1.1793 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4213 -0.8372 -0.4089 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0767 0.4220 0.1326 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2564 1.0340 -0.2922 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0967 -0.8971 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4729 0.3323 -0.2785 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4931 -1.0090 0.1724 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2963 -1.6092 0.5963 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5079 -0.5089 -0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6698 0.9324 -0.7024 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7096 -1.7107 0.1862 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8693 0.2204 -0.6819 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8892 -1.0986 -0.2385 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1122 0.8372 -0.8014 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7415 -1.2609 0.4243 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9218 -0.8025 1.6504 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7013 2.5436 -0.0407 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1538 1.5698 1.3567 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9047 -2.3673 0.0764 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4607 -1.3672 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6188 0.8781 -1.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8255 1.3538 -0.3906 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3278 2.4917 0.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7469 1.3618 2.2007 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0373 -2.3322 -0.7704 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9939 -1.0455 -1.9659 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0301 0.0454 1.6999 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2393 2.0676 -0.6341 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1966 -1.4201 0.8852 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2877 -2.6415 0.9403 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6781 1.9624 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4714 -0.2172 0.3299 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7488 -2.7426 0.5288 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7880 0.6962 -1.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8235 -1.6524 -0.2228 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 24 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 13 1 0 0 0 0 12 19 3 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 14 38 1 0 0 0 0 15 18 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 40 1 0 0 0 0 19 42 1 0 0 0 0 20 22 1 0 0 0 0 20 41 1 0 0 0 0 21 23 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 M END $$$$