MMs03082313 MOE2007 2D CORINA 3.40 0006 02.08.2006 67 67 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 1.2948 -0.7572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2865 -2.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0145 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 -1.2145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6064 1.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9096 2.2283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3115 2.2427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3199 3.7427 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3199 4.9427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6231 4.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0334 5.9999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2782 3.7572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 4.5144 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5730 3.3144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8762 3.7716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1710 4.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1627 6.0288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5647 6.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8595 6.7716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8929 -0.7717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2044 1.4711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4909 -0.7861 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4909 0.4139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0890 -0.8006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6870 -0.8150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6786 -2.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3755 -3.0578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0806 -2.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9735 -3.0722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4826 -2.2861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1794 -3.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1710 -4.5288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8845 -2.2716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6058 1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 0.6058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6058 -1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2556 -1.3572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0865 -2.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2798 -3.4572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4865 -2.2639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 1.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2173 3.4429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6656 5.0797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0289 5.5280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2848 2.5572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 2.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6526 2.8567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5221 6.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8895 -1.3717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0279 0.8802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5706 0.8716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3988 1.1422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7295 -0.2208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3688 -4.2578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0381 -2.8948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0160 -2.4780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5184 -2.8919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4903 -1.2358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8487 -1.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2788 -3.3075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4742 3.7861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5101 4.3919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 42 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 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 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 2 0 0 0 0 18 66 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 35 1 0 0 0 0 27 28 1 0 0 0 0 27 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 34 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 62 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 63 1 0 0 0 0 38 64 1 0 0 0 0 38 65 1 0 0 0 0 66 67 1 0 0 0 0 M END