MMs02594888 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 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 -0.7443 -1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0113 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2443 -1.3089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9886 -2.6112 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5886 -3.6504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -3.9069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9773 -5.2092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4886 -2.6177 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2443 -1.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7443 -1.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0393 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8869 1.1704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4296 2.5990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3114 0.7006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5288 1.5770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8964 0.9609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0467 -0.5316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4144 -1.1476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6317 -0.2713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4814 1.2212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1138 1.8373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3049 -0.7994 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.8763 -1.2567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4065 -2.6812 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0418 -0.5955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5955 1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0418 0.5955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4557 -1.3023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0253 -3.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6159 -3.6347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0479 -1.9935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0411 -0.1262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3737 -0.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0841 -3.6595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5307 -2.5094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8701 -1.7439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3741 0.3826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7135 1.1481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4086 2.7709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0728 -1.2327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5346 -2.3416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7258 -0.7641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4553 1.9223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9936 3.0312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -3.9004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1284 -4.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 48 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 48 49 1 0 0 0 0 M END