LABK16 -OEChem-05022322163D 35 37 0 1 0 0 0 0 0999 V2000 5.7914 1.2248 -0.5435 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2524 -0.5995 0.1213 N 0 0 2 0 0 0 0 0 0 0 0 0 -0.4380 0.2684 1.2907 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4714 -1.3902 -0.1243 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 1.3215 0.9925 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7266 -0.5504 -0.1876 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7572 0.7316 0.3875 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8985 -1.4824 0.3074 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2008 -0.7618 0.0804 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -1.0754 -0.7664 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9383 1.4837 0.3423 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0638 -0.3228 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0872 0.9563 -0.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3492 0.0816 -1.0208 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2591 -0.9374 0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5559 0.7490 -1.2305 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4658 -0.2701 0.7623 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6142 0.5731 -0.3389 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4859 0.7998 1.5487 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7255 -0.3218 2.1719 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6095 -2.1450 0.6617 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3591 -1.9133 -1.0823 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1083 2.0628 0.2898 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7602 1.8439 1.9236 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8753 -2.2969 -0.4297 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8731 -1.9610 1.2955 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8868 -2.0742 -1.1955 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9681 2.4844 0.7655 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9603 -0.7346 -1.2523 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0006 1.5431 -0.2747 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5423 0.2240 -1.7346 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1576 -1.5917 1.8336 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6666 1.4027 -2.0914 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2826 -0.4154 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4106 0.9876 0.1682 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 3 5 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 15 17 2 0 0 0 0 15 32 1 0 0 0 0 16 18 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 M END $$$$