D0PM7Q -OEChem-10121504072D 44 46 0 1 0 0 0 0 0999 V2000 6.0600 -0.2997 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -3.8874 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 2.3739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3580 0.4423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6166 2.8694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 1.3559 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9568 1.4604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5391 2.1649 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1989 2.1649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6056 3.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0179 3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2044 2.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0233 3.7829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7812 1.4604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 0.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3690 0.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 -0.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6780 -0.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 -1.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 -2.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7350 -2.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9513 1.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 -3.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7350 -3.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 -3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 1.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1196 2.7317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0363 3.5244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5751 4.1592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 4.4834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6471 1.7886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3753 1.4644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0666 4.4014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4218 3.9329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5345 0.7895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2677 -0.4913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7046 2.0268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 -2.0775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2720 -2.0775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2720 -3.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 -4.5075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1557 2.1001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2869 2.7313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 17 1 0 0 0 0 2 23 1 0 0 0 0 3 14 2 0 0 0 0 4 22 2 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 35 1 0 0 0 0 9 6 1 6 0 0 0 6 14 1 0 0 0 0 6 36 1 0 0 0 0 7 16 1 0 0 0 0 7 22 1 0 0 0 0 7 38 1 0 0 0 0 8 22 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 18 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 23 1 0 0 0 0 20 39 1 0 0 0 0 21 24 2 0 0 0 0 21 40 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$