MMs02412849 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 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 1.1169 -1.0013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5425 -0.5346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6594 -1.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0849 -1.0693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5454 0.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0454 0.3616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5120 -1.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3004 -1.9483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4604 -3.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8321 -4.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0437 -3.1625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8836 -1.6711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0952 -0.7868 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.4669 -1.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6785 -0.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0501 -1.1167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.2617 -0.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1017 1.2591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6334 -0.8395 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.8450 0.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7934 -2.3309 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1651 -2.9380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 0.8935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8935 0.8010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -0.8935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1729 -1.7421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6826 -2.0596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9768 0.5237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4865 0.2062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7154 -2.2767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2251 -2.5942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8379 1.3276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9601 -5.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7980 -2.3902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3319 -2.2256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8135 0.3222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3473 0.4868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1782 -2.3098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5524 -0.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8143 0.7523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1375 1.0141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 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 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 M END