B8ZND1 -OEChem-04042102383D 42 44 0 0 0 0 0 0 0999 V2000 3.5083 -0.6566 -0.8550 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7231 1.6266 1.4572 F 0 0 0 0 0 0 0 0 0 0 0 0 4.3656 -1.7928 -1.1346 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 0.2340 -1.9264 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1828 0.2706 0.3927 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8817 -0.2510 -0.3157 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9217 -2.9857 1.1828 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0498 -0.6809 -0.8558 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3109 1.4222 -0.0013 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1677 0.4214 -1.0017 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9642 1.4951 0.0617 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0843 1.1014 -0.9025 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 2.0552 1.3596 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0219 2.5086 -0.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -1.2630 -0.1031 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8361 -0.5519 -0.1896 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -1.0563 0.4093 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5915 -0.3257 0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0179 -2.4639 0.5881 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2181 -2.2664 1.0777 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6561 -0.9185 -0.2434 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7824 1.0201 0.8788 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0711 1.0348 0.1985 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9582 1.6687 0.8137 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8602 0.3539 -0.6398 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6458 0.3455 1.2672 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7470 1.9542 -1.0911 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6971 0.2922 -0.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7162 0.7675 -1.8776 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1573 2.9460 1.1716 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1817 1.3139 1.8602 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7546 2.3328 2.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4279 3.5226 -0.4848 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 2.5092 -0.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8982 2.3659 -1.6655 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8005 0.3966 -0.7198 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9139 -3.0662 0.6979 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6277 -1.9122 -0.6774 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0749 -2.7145 1.5728 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0685 2.6671 1.2212 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 1.2377 -0.8112 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6365 -0.3410 -1.4803 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 2 22 1 0 0 0 0 5 11 1 0 0 0 0 5 26 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 6 23 1 0 0 0 0 7 19 1 0 0 0 0 7 20 2 0 0 0 0 8 25 2 0 0 0 0 9 23 2 0 0 0 0 9 25 1 0 0 0 0 10 25 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 37 1 0 0 0 0 20 39 1 0 0 0 0 21 38 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$