LJQ7F6 -OEChem-05032301122D 50 52 0 1 0 0 0 0 0999 V2000 4.0344 5.0637 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 2.4276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6222 5.8727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1208 4.6570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9424 5.3659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0772 4.3759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 0.8888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1637 3.9691 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4411 4.1502 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8479 3.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 2.4276 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5691 1.4766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -5.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 -5.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 -5.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5276 3.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3547 4.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6276 5.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 1.4766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -0.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -4.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -0.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -2.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -3.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -1.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -1.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2786 2.7906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3619 3.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9786 2.9800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8791 0.9396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1355 1.7287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1612 -4.9508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6775 -5.7652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1524 -6.5878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3677 -6.5878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8427 -5.7652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2754 4.3098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9612 3.4913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7798 3.1770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 6.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3755 6.5437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0612 5.7251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0989 3.3525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -0.3012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -0.3012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -1.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -1.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5788 4.0114 0.0000 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 10 1 0 0 0 0 1 19 1 0 0 0 0 2 12 1 0 0 0 0 2 20 1 0 0 0 0 5 18 2 0 0 0 0 6 20 2 0 0 0 0 7 9 1 0 0 0 0 7 50 1 0 0 0 0 8 13 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 18 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 6 0 0 0 10 18 1 0 0 0 0 12 11 1 1 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 22 26 3 0 0 0 0 23 27 1 0 0 0 0 23 46 1 0 0 0 0 24 28 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M END $$$$