BS0U6Q -OEChem-04022110163D 49 50 0 1 0 0 0 0 0999 V2000 0.7617 0.6593 -0.9626 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 1.1243 -2.2716 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5285 -0.7356 -0.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0675 0.6379 -0.9385 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6127 1.5462 -0.4646 N 0 0 1 0 0 0 0 0 0 0 0 0 -2.8570 -0.8633 0.8283 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3738 1.0073 0.6967 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8521 2.0907 1.6571 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 3.0272 -0.5229 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5214 3.2806 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8721 3.6490 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5145 0.2564 0.0896 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9283 1.2807 0.2182 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0619 0.3051 0.2961 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9418 -1.7472 0.4672 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4887 -2.8816 -0.4458 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9894 0.2296 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1903 -0.5279 1.4074 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4349 -3.7780 0.2089 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0454 -0.6789 -0.6707 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2462 -1.4364 1.4798 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0469 -4.9336 -0.7003 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1738 -1.5119 0.4406 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7416 0.3193 1.2705 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9837 2.4649 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5376 1.6735 2.4046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0875 3.3266 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1802 3.3955 0.2581 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4929 4.1422 1.6481 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5834 3.0648 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5199 3.3146 -1.1821 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8054 4.7395 -0.4495 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2784 2.2678 -0.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4407 1.3726 1.1928 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3366 -1.0837 1.6723 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3599 -2.1462 1.3973 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7236 -1.1638 -0.0313 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0827 -2.4658 -1.3764 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3635 -3.4845 -0.7177 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 0.8772 -1.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4739 -0.4820 2.2234 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -4.1782 1.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5353 -3.1984 0.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7686 -0.7366 -1.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 -2.0855 2.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6271 -4.5671 -1.6425 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2937 -5.5616 -0.2143 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9143 -5.5603 -0.9307 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 -2.2192 0.4971 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 5 1 0 0 0 0 1 13 1 0 0 0 0 4 12 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 24 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 19 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 20 1 0 0 0 0 17 40 1 0 0 0 0 18 21 2 0 0 0 0 18 41 1 0 0 0 0 19 22 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 23 2 0 0 0 0 20 44 1 0 0 0 0 21 23 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 M END $$$$