D04RQU -OEChem-10101305022D 27 30 0 0 0 0 0 0 0999 V2000 6.2645 -1.3160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5748 1.8507 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7881 -2.2697 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7841 -1.1211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -0.6211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6501 -0.6211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7841 0.8789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8001 -2.1626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6501 0.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 1.0460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5861 1.9538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 -1.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -1.1279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9021 -2.6903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0861 2.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 0.6889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5743 0.9182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9889 2.3122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0741 -2.8198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4747 -0.8117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9045 -3.3103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -2.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6231 3.1298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7761 3.3568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5492 2.5098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 2 20 1 0 0 0 0 3 9 1 0 0 0 0 3 13 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 8 2 0 0 0 0 6 11 1 0 0 0 0 7 10 2 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 9 15 2 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 17 1 0 0 0 0 14 16 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 M END $$$$