MMs01063690 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4703 0.2970 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1597 -0.8621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5748 -0.7179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8814 0.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3032 -0.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 0.5334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 2.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7092 2.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5844 1.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0942 1.6611 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3574 2.9677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1205 4.2590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1425 2.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8498 0.0554 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3719 -1.3664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3278 1.4773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2717 -0.4225 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5687 -1.8928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3965 0.5699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8183 0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2674 -1.3392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7673 -1.3544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2452 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0407 0.9613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2376 1.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1762 -0.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2376 -1.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -1.5118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2703 -1.6958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5408 -1.6352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0308 2.7976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4715 3.6578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1304 4.1828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3425 2.9950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1547 1.7829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3924 -2.1304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8063 -3.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7449 -1.6552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4584 1.3182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9705 1.6237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5522 -2.3029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4628 -2.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3902 0.4267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 M END