L28TIO -OEChem-05022322182D 31 31 0 0 0 0 0 0 0999 V2000 3.4013 2.1878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5855 -0.1257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -1.0736 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0503 -1.7730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 -0.4858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 -0.4858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 1.2743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 1.2743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3222 -0.7948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 2.1878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8424 -0.7948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0014 -2.0820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6008 0.8283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6841 1.6210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -1.6936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1306 -0.2052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7326 -0.9864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5138 -1.3845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3298 2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5112 2.7542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 1.9356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9352 1.7864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 1.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0648 0.5531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5895 -2.1878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8098 -2.6716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5910 -2.2736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1929 -1.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 13 2 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 18 1 0 0 0 0 4 13 1 0 0 0 0 4 15 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 5 9 1 0 0 0 0 6 8 2 0 0 0 0 6 10 1 0 0 0 0 7 13 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 14 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 M END $$$$