MMs03082015 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 64 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 1.5000 0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2568 -1.2871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2431 1.3109 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8431 2.3501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4863 2.6060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2294 3.9089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0137 2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7706 3.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7431 1.3188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7568 -1.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7568 -1.2634 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2567 -1.2555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0136 -2.5505 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6136 -1.5113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2705 -3.8535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0273 -5.1486 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2704 -3.8377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7704 -3.8298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5272 -5.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0272 -5.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7703 -3.8139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0135 -2.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5135 -2.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2703 -3.8060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0135 -2.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5134 -2.4951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2703 -3.7902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5271 -5.0932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0272 -5.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0063 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0063 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.0313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2208 -1.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8623 -2.3232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2929 -0.6817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2655 4.4986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 4.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8066 3.2876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3376 2.3612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7853 1.2123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1254 0.4480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1623 -2.3058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3471 -3.0870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3553 -4.6297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4328 -6.1910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4850 -5.0183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1450 -4.2541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9327 -6.1672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6327 -6.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6080 -1.4765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9080 -1.4908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4080 -1.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1079 -1.4528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4703 -3.7839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1326 -6.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4327 -6.1435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5136 -2.5426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1081 -1.5002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 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 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 62 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 62 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 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 33 61 1 0 0 0 0 62 63 1 0 0 0 0 M END