L68KON -OEChem-05032300113D 39 40 0 1 0 0 0 0 0999 V2000 0.4208 -2.2113 2.2863 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -1.6762 -2.7192 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0123 2.2553 1.7149 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6527 -1.3439 1.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1034 2.6225 -0.5329 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3487 2.1049 0.2841 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5561 2.6275 0.2392 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7593 -0.0695 1.0649 N 0 0 1 0 0 0 0 0 0 0 0 0 0.1332 -0.7782 -0.6035 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6419 -0.2663 -0.7724 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 0.3622 0.3200 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4958 0.2341 0.3922 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8699 -1.7897 -0.2370 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0973 -0.1156 -1.1357 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9073 0.1367 -2.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9003 -1.4577 1.5311 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7818 -0.8579 -1.8388 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3758 -2.8414 0.7637 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1411 -1.1177 0.1975 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0302 1.8593 0.4187 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8667 0.4833 -0.6102 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6469 1.8397 0.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8515 0.0148 0.8487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5178 1.2173 -0.0902 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2963 0.3263 1.1423 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1393 -2.3493 -1.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3198 -1.1905 -1.1337 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9767 0.3716 -1.5776 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 0.0030 -3.0982 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5261 1.1598 -2.0035 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6719 -1.4751 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2496 -2.1247 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2056 -3.4854 1.0762 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3519 -3.4973 0.2715 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1223 -0.1407 -1.6363 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0635 3.2311 1.8005 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5523 -0.0831 0.0269 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2983 0.6185 -1.6057 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2316 2.9922 0.6855 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 18 1 0 0 0 0 2 17 2 0 0 0 0 3 20 1 0 0 0 0 3 36 1 0 0 0 0 4 19 2 0 0 0 0 5 20 2 0 0 0 0 6 22 1 0 0 0 0 6 39 1 0 0 0 0 7 22 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 16 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 17 1 0 0 0 0 10 19 1 0 0 0 0 10 21 1 0 0 0 0 10 35 1 0 0 0 0 11 14 1 0 0 0 0 11 20 1 0 0 0 0 11 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 M END $$$$