MMs00557921 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 0.7596 -1.2935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2595 -1.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2594 -1.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -2.5648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0191 -2.5759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2787 -3.8804 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0382 -5.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7787 -3.8915 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.7594 -1.2493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5189 -2.5427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 0.0553 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7593 -1.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2593 -1.2161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9997 0.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2401 1.3819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7402 1.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9806 2.6643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7210 3.9689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4996 0.0995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2400 1.4040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0188 -2.5096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2784 -3.8141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0348 0.6076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6076 1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0348 -0.6076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3923 1.0569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0922 1.0768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1267 -3.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8922 1.0900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1670 -2.2708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8324 2.4255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2837 0.8117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8324 2.4476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1964 1.9963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2348 -3.2218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6861 -4.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3220 -4.4064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4807 2.6533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 3.6881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 32 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 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 23 24 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END