MMs01048868 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.3009 0.7468 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2616 1.3468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8989 0.7404 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9026 2.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6054 2.9936 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5662 3.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3046 2.2468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6091 4.4936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1924 -1.5128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 0.7340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0192 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0951 0.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2555 2.2190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7235 2.5273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4703 1.2264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4639 0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9239 -1.3136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3904 -1.6290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3968 -0.5168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9368 0.9109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3370 3.8961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4583 5.1118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9661 4.9587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0718 6.4806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 7.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3314 8.8937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7002 8.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5398 6.7889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5974 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 -0.5974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5974 -1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8245 -0.9237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3672 -0.9275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0839 2.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3158 3.3670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8091 4.4906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6121 5.6936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4091 4.4965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7279 1.6552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2706 1.6514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3657 3.0242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1188 -2.2034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7584 -2.7712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5700 -0.7692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7419 1.8007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3302 3.2226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1727 4.7573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3524 7.0785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5242 8.6752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3623 9.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9340 9.9315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0739 9.4206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8734 8.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6623 5.5951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7398 6.7859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END