L98EGR -OEChem-05022321353D 53 55 0 0 0 0 0 0 0999 V2000 7.8836 0.2613 0.1708 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.4524 2.1488 -1.9046 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.4703 2.3679 -1.0518 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.9473 0.6183 -2.2519 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4246 -3.9560 -0.5255 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 1.7725 0.3096 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1723 1.4533 0.9556 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4909 -1.0105 0.5384 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1498 -1.1468 -0.5319 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9732 -0.4114 -0.0355 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6149 -0.1660 0.3048 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5436 0.6177 0.6727 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3941 0.0895 0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7981 -1.0008 -0.7037 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0057 -0.0525 0.6802 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9402 -2.1888 -1.1515 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5803 1.7938 1.5683 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8946 0.7142 -0.0732 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9599 0.5592 0.1069 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -3.5329 -0.4495 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4546 -0.7247 1.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2324 0.8087 0.3102 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4503 1.4506 -1.2964 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7925 -0.6301 2.2004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3799 -0.2513 0.0137 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6814 0.1366 1.4471 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1499 0.0640 0.1103 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9309 1.0118 0.2299 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2139 -1.3568 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 1.1694 0.2782 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5989 -1.1991 -0.1056 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3497 0.5901 -1.5138 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -1.6722 -1.3486 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5942 -2.2621 -2.1899 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -1.8935 -1.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7889 1.7323 2.3227 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5308 1.8793 2.1039 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4381 2.7146 0.9935 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4057 -4.2879 -0.9354 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0622 -3.4631 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7755 -1.3269 2.4161 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9431 1.3999 -0.2605 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -1.3736 -0.1792 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1421 -1.1535 3.0855 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 0.2100 1.7458 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3513 1.9134 0.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7975 -2.3463 -0.3246 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7244 2.1631 0.4404 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 -2.0723 -0.2451 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3677 -4.8133 -0.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4325 0.7292 -1.5449 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0658 -0.2621 -2.1341 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8482 1.4996 -1.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 1 8 2 0 0 0 0 1 27 1 0 0 0 0 1 32 1 0 0 0 0 2 23 1 0 0 0 0 3 23 1 0 0 0 0 4 23 1 0 0 0 0 5 20 1 0 0 0 0 5 50 1 0 0 0 0 6 19 2 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 16 1 0 0 0 0 10 19 1 0 0 0 0 10 25 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 33 1 0 0 0 0 15 18 1 0 0 0 0 15 21 2 0 0 0 0 16 20 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 24 1 0 0 0 0 21 41 1 0 0 0 0 22 26 1 0 0 0 0 22 42 1 0 0 0 0 24 26 2 0 0 0 0 24 44 1 0 0 0 0 25 28 2 0 0 0 0 25 29 1 0 0 0 0 26 45 1 0 0 0 0 27 30 2 0 0 0 0 27 31 1 0 0 0 0 28 30 1 0 0 0 0 28 46 1 0 0 0 0 29 31 2 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END $$$$