DR3168 -OEChem-08132116382D 40 42 0 0 0 0 0 0 0999 V2000 2.5326 -2.7094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2647 0.2906 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 2.3784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2077 2.3784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3987 0.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3987 1.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8987 3.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8987 3.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 0.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2647 -0.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 0.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 1.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3987 -1.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 -1.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8628 1.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8628 0.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 2.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3987 -2.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 -2.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2647 -2.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7288 2.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7881 0.8982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1866 0.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9635 3.9460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2922 3.4583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5051 3.4583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8339 3.9460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 -0.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5938 2.1006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 -0.8994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6677 -0.8994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3997 0.4806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 2.9106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6677 -2.5194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2647 -3.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0388 1.7536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2657 2.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4188 2.8275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5326 -3.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 40 1 0 0 0 0 2 5 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 28 1 0 0 0 0 4 6 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 16 1 0 0 0 0 11 29 1 0 0 0 0 12 17 2 0 0 0 0 12 30 1 0 0 0 0 13 18 1 0 0 0 0 13 31 1 0 0 0 0 14 19 2 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END $$$$