B2EDN9 -OEChem-04022113553D 32 33 0 0 0 0 0 0 0999 V2000 -2.7280 -3.2941 -0.8157 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4503 0.9907 0.0576 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1309 -1.3972 1.3442 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8777 2.7114 0.6587 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -0.7334 -0.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9248 1.0992 -0.1673 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 1.8650 0.1654 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4545 0.1954 0.7537 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5544 1.2916 -1.3972 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6139 -0.5162 0.4449 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 0.5393 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7138 0.5803 -1.7059 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2435 -0.3238 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6556 1.5536 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9773 0.8585 0.3985 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2448 -1.7637 -0.3622 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9913 -0.1565 0.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6777 -1.4094 -0.1173 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3189 -2.0905 0.9645 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 2.2580 1.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5496 2.7132 -0.5181 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 0.0416 1.7134 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1517 1.9911 -2.1248 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2031 0.7305 -2.6639 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 -0.8429 -1.0893 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3481 -0.9238 -0.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3012 1.8508 0.6915 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0226 0.1246 0.4252 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 -2.1686 -0.2334 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5893 -2.7483 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1571 -1.4013 0.8163 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1493 -2.7315 0.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 7 1 0 0 0 0 2 14 1 0 0 0 0 3 10 1 0 0 0 0 3 19 1 0 0 0 0 4 14 2 0 0 0 0 5 11 1 0 0 0 0 5 16 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 9 12 2 0 0 0 0 9 23 1 0 0 0 0 10 13 2 0 0 0 0 11 14 1 0 0 0 0 11 15 2 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 16 18 1 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 M END $$$$