MMs01725857 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 63 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 1.2937 -0.7592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -2.2592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0213 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2617 -5.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -4.5183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5767 -3.0184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -2.2776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -0.7777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1747 -3.0368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4790 -2.2961 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4790 -3.4961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4897 -0.7961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0771 -2.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7727 -3.0553 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8120 -3.6553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7621 -4.5552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0557 -5.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6857 -0.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2837 -0.8515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5881 -0.1107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5987 1.3892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9031 2.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1967 1.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1861 -0.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8817 -0.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5011 2.1115 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2511 -6.7591 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.3363 -5.2406 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6074 1.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6074 -1.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0563 -2.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 -5.1257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1662 -4.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3065 -0.9961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0873 0.3344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0292 0.8693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5719 0.8584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4795 -3.4451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2603 -2.1146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4484 -6.3494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0907 -5.9218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6631 -4.2795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1699 0.8399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6272 0.8509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9079 -1.7468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4505 -1.7577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2253 0.8324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7679 0.8215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5638 1.9966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9116 3.3300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2210 -0.7365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8732 -2.0699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3712 -4.6333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3448 -6.4406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0877 -0.8146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 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 32 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 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 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 61 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 61 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 M END