MMs01788382 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 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 0.7512 -1.2984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2512 -1.2970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2512 -1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5023 -2.5940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0023 -2.5954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2535 -3.8951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7535 -3.8964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 -3.7078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1965 -5.1753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8768 -3.0965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7187 -1.6049 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7187 -0.4049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0884 -0.9935 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0931 -2.1073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3443 -3.4071 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5443 -3.4071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9556 -4.7768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0751 -5.9911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4476 -4.9323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0589 -6.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5508 -6.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4314 -5.2432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9233 -5.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5347 -6.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6541 -7.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1622 -7.8273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2816 -9.0416 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0387 0.6009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6009 1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 -0.6009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3991 1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0991 1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7524 -2.6964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4465 -3.8975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7546 -5.0964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8953 -1.2149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0646 -2.8118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1520 -3.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8948 -6.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1437 -7.4990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9423 -4.1474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6278 -4.4272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7282 -6.8928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1431 -9.0785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 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 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 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 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 M END