MMs00212967 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2471 -1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4942 -2.6014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0058 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7529 -1.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2529 -1.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1373 -2.5056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5628 -2.0389 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5595 -0.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1319 -0.0785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7710 0.3455 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1427 -0.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3543 0.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1942 2.1142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7259 0.0157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9375 0.9001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3092 0.2931 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3092 1.4931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6243 -1.1735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1164 -1.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7235 0.0447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6065 1.0460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7471 -1.3074 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7438 -2.8074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7504 0.1926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2471 -1.3107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1261 -2.5262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5537 -2.0658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 -0.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1315 -0.0992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5977 1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1023 1.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0919 -3.6420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6081 -3.6360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4739 -1.2579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0078 -1.0932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8540 -1.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0724 1.7318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6063 1.8965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4312 -1.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6270 -2.3735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8695 -2.5013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2585 -1.6952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7640 -0.5529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4267 1.0171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0855 -3.1239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6117 -3.6235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8006 -3.2402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7474 -1.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7502 -0.6939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8091 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0936 0.5032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6220 0.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 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 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 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 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END