MMs02296673 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 -1.4999 0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2388 1.3183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4777 2.6108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0223 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7611 1.2926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2611 1.2797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0257 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2387 -1.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7386 -1.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4774 -2.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7163 -3.9549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9774 -2.6752 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5685 -3.7195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7385 -1.3826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0772 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4997 -0.0643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7609 1.2411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2609 1.2540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2384 -1.3955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7387 1.3311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 0.0386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4776 2.6366 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9775 2.6494 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3775 3.6887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7386 1.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2386 1.3697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 0.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4996 0.0900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7163 3.9549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9552 5.2474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 -1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1088 -1.0212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0687 3.6552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6312 3.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0628 2.4632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3922 1.6804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6298 -2.3781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6699 2.2983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8295 -2.4398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8473 -0.3614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8687 3.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6145 0.9368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9571 0.1769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0201 2.5497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3626 1.7898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2608 -1.2282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2163 3.9677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8073 5.0121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8697 -2.2623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 20 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 18 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 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 31 32 2 0 0 0 0 31 49 1 0 0 0 0 48 51 1 0 0 0 0 49 50 1 0 0 0 0 M END