MMs03743435 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 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 -0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2476 -1.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4953 -2.6008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0047 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7524 -1.2977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7571 -3.8957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2571 -3.8930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -5.1049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6801 -6.5323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5667 -4.6388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 -3.1388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7759 -2.2549 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1366 -2.6779 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7819 -5.5182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1511 -4.9056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3662 -5.7851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7354 -5.1725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8895 -3.6804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6743 -2.8010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3051 -3.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2429 -3.9012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7429 -3.9040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4905 -5.2044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7381 -6.5020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4858 -7.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9858 -7.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7381 -6.5075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9905 -5.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2381 -6.5102 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5981 1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1019 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4476 -1.3053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9524 -1.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -4.9361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9202 -6.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4547 -6.5119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2430 -6.9787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7075 -5.8761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9848 -3.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -2.7100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5367 -2.7218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8713 -3.4956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5381 -6.4998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8839 -8.8406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5839 -8.8455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5924 -4.1690 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 22 23 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 30 1 0 0 0 0 29 47 1 0 0 0 0 M END