MMs01680450 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.4605 -0.3418 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6120 -1.1904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4868 0.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9474 0.4103 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9737 1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6919 2.9775 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0060 3.7008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3479 5.1613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7836 5.5955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8776 4.5692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5357 3.1087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1000 2.6744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4619 1.3169 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1852 0.0028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6849 -0.0279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4613 1.2555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4081 -1.3420 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9078 -1.3727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6842 -0.0893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1839 -0.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9072 -1.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1307 -2.7176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6311 -2.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8540 -4.0317 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.4069 -1.4649 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8948 -1.7776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2735 1.1684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1684 0.2735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2735 -1.1684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4824 1.4087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 1.8553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2947 -0.7384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4727 5.9823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0571 6.7639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0262 4.9166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4109 2.2876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0494 -0.3845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3693 -1.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7870 -2.3688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1056 0.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8051 0.9067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0099 -3.7136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0632 -2.0511 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 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 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 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 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 43 1 0 0 0 0 27 44 1 0 0 0 0 M END