MMs01798649 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 1.2938 -0.7590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2834 -2.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8918 -0.7771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4898 -0.7951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8045 1.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5107 2.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2065 1.4638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1087 2.1867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4747 1.5671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4862 2.6748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7452 3.9791 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2758 3.6774 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3648 5.3451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8577 5.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4773 6.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6040 8.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1112 7.9308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4916 6.5647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7764 0.0978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1997 -0.3757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6533 -1.8054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7632 -3.0128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1533 -1.8159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6267 -0.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0565 0.0611 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.4193 0.4976 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.0265 -3.0355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4069 -4.4015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2801 -5.6212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7729 -5.4747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6072 1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 0.6072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6072 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2546 -1.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0834 -2.2506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -3.4589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4833 -2.2673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8331 0.9065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3757 0.8958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4815 -1.9951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8291 -0.6614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 3.4048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1714 2.0711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6787 2.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5562 4.5158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6715 6.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0997 9.1700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4126 8.9065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2973 6.4476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8791 -0.6990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8661 -2.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0167 -3.7134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4167 -3.7236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5673 -5.2589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6605 -6.9872 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 34 2 0 0 0 0 33 59 1 0 0 0 0 M CHG 1 59 -1 M END