B5O3DA -OEChem-04012118262D 40 42 0 0 0 0 0 0 0999 V2000 7.2566 1.8338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.0891 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.2844 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2844 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7844 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 3.3224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -3.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.4796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.4709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -3.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -3.7839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 1.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 1.6276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 2.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 2.3719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 1.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1815 -3.6289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8396 -3.8525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5741 -3.3737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0953 -2.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8596 -3.3698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -4.2454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7826 -4.1980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 0.2156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 1.0873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 2.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.0944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.0256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.0256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5069 3.7839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5276 3.4503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4630 0.6755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3385 0.6281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3859 1.5036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 3 11 2 0 0 0 0 4 9 2 0 0 0 0 4 21 1 0 0 0 0 5 15 1 0 0 0 0 5 21 2 0 0 0 0 6 15 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 20 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 17 19 2 0 0 0 0 17 31 1 0 0 0 0 18 20 2 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 21 33 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$