BO5R4T -OEChem-04012119582D 50 52 0 1 0 0 0 0 0999 V2000 4.4757 -6.3176 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.9398 -6.3176 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5768 4.1980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5267 -0.0562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 5.8160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.7979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0168 -2.7298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3987 -2.7298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7078 -1.7787 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 4.0934 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1756 3.1799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 2.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9836 5.1115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7579 2.4754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3566 1.4573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 4.9024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9781 5.2160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 5.9205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9389 0.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3457 1.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9444 0.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -0.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7078 -1.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2078 -4.3176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2078 -3.3176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0738 -4.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -4.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3417 -5.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0738 -5.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2078 -6.3176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8345 4.6598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6616 3.5266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7449 2.7339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 4.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 3.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 1.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0429 4.5994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5947 5.2808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9133 5.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8974 6.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0314 6.4221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8942 5.5561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9623 1.7312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6922 0.0819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -0.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6893 -1.4157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0368 6.3176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6107 -4.5076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8048 -4.5076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2078 -6.9376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 29 1 0 0 0 0 3 10 1 0 0 0 0 3 13 1 0 0 0 0 4 19 1 0 0 0 0 4 22 1 0 0 0 0 5 16 1 0 0 0 0 5 47 1 0 0 0 0 6 16 2 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 8 23 1 0 0 0 0 8 25 2 0 0 0 0 9 23 2 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 13 34 1 0 0 0 0 14 20 1 0 0 0 0 14 35 1 0 0 0 0 15 21 2 0 0 0 0 15 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 26 29 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 30 1 0 0 0 0 29 30 2 0 0 0 0 30 50 1 0 0 0 0 M END $$$$