LF1A0J -OEChem-05022322423D 28 29 0 1 0 0 0 0 0999 V2000 -4.4157 1.2421 1.5306 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -0.0697 1.1288 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9493 -2.2372 0.4418 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 1.6067 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9244 -0.7311 -2.2992 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3445 0.2635 -0.7544 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4345 -0.7047 0.0825 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0678 -0.1061 0.0313 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0653 -0.8992 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2325 -0.4166 -1.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0688 1.2625 -0.2015 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3349 -0.3235 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3383 1.8381 -0.2522 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4715 1.0451 -0.0705 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3134 0.4643 0.5796 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1594 -2.9719 0.6162 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8253 0.7379 0.0732 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4431 -1.7832 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7979 1.9022 -0.3435 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2147 -0.9329 0.3019 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4385 2.9048 -0.4333 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0789 0.5881 -1.3725 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8768 -4.0161 0.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7074 -2.6462 1.5071 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7765 -2.9589 -0.2888 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7278 1.3540 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8936 -0.0160 -0.7186 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8245 0.2963 1.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 7 1 0 0 0 0 2 15 1 0 0 0 0 3 9 1 0 0 0 0 3 16 1 0 0 0 0 4 14 1 0 0 0 0 4 17 1 0 0 0 0 5 10 2 0 0 0 0 6 10 1 0 0 0 0 6 15 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 18 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 11 13 2 0 0 0 0 11 19 1 0 0 0 0 12 14 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 M END $$$$