MMs01505620 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.7430 -1.3030 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3430 -0.2638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -1.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9861 -2.6141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2569 1.2709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5138 2.5740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7569 1.2629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5138 2.5579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0138 2.5499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7568 1.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2568 1.2388 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0139 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5139 -2.5900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -1.3718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8181 -1.8277 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3481 -0.4245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3059 -1.6369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8261 -3.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -3.7988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -5.2677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2181 -6.2654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6422 -5.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9462 -4.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0424 0.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5944 1.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0424 -0.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4055 1.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0944 -1.0665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9194 3.6003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6193 3.5859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5943 -1.0906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8943 -1.0761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5805 -3.6405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9587 -5.6446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9749 -7.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5382 -6.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0855 -3.9485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 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 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 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 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 M END