23327 -OEChem-03292402583D 19 18 0 1 0 0 0 0 0999 V2000 2.0909 -1.6869 -0.3513 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 0.0102 1.2337 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6515 -0.1520 1.2201 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9058 -0.4276 -0.9753 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4996 1.8871 -0.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1289 0.1615 -0.8999 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3481 0.5510 -0.7212 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9934 0.1912 0.3637 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0968 -0.4291 0.1646 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4509 -0.1053 0.1146 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1894 -0.8419 -1.3414 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5753 0.8362 -1.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8428 0.5448 -1.6999 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6219 -0.5474 1.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9414 1.1839 0.8241 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 2.5660 -0.7338 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4832 2.1552 -0.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5749 -2.3190 0.2218 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1522 -0.1908 1.0594 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 18 1 0 0 0 0 2 10 1 0 0 0 0 2 19 1 0 0 0 0 3 9 2 0 0 0 0 4 10 2 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 M END > 23327 > 0.6 > 1 24 16 23 11 28 2 4 21 5 13 8 27 14 17 25 12 9 26 19 22 6 20 7 15 18 10 3 > 13 1 -0.65 10 0.66 16 0.36 17 0.36 18 0.5 19 0.5 2 -0.65 3 -0.57 4 -0.57 5 -0.99 7 0.33 8 0.06 9 0.66 > 4 > 8 1 1 acceptor 1 2 acceptor 1 3 acceptor 1 4 acceptor 1 5 cation 1 5 donor 3 1 3 9 anion 3 2 4 10 anion > 10 > 1 > 0 > 0 > 0 > 0 > 1 > 1 > 00005B1F00000001 > 6.2637 > 40.714 > 10219947 1 18410283718909468050 12932741 1 17313100878061886917 12932764 1 18260555566760023597 14390081 3 14404911262857900619 15775835 57 17132398314989802771 20201158 50 17821721706764874378 20653091 64 17894640244483226532 20711985 344 17390221529819551636 21028194 46 12103553195627759654 23552449 11 18186515527255393804 29004967 10 18335414634799994884 3248919 1 18343584074940325023 > 177.34 4.8 1.2 1.08 2.72 0.23 -0.09 -1 -0.94 -1.04 0.1 0.23 -0.08 0.02 > 336.574 > 108.5 > 2 5 10 $$$$