MMs01792169 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 49 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 0.7530 -1.2973 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3530 -0.2581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -2.5911 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4084 -3.6317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 -2.5877 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9060 -3.6269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 -1.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7530 -1.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7470 1.3216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9940 2.6189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2470 1.3250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 -3.8850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -5.1857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -3.8954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -5.1996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 -6.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -6.5038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -5.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 -3.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -3.9023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -2.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -1.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0378 0.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6024 1.0378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0378 -0.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1244 -0.8791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4586 -0.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5473 -2.4657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8816 -1.6912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3714 0.4252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7056 1.1996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6024 -1.0170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8494 0.2872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8446 2.3657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -3.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6326 -7.5382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3326 -7.5445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6880 -5.2093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3434 -2.8679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 -3.8815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3614 -4.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 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 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 47 48 1 0 0 0 0 M END