MMs01167648 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 49 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 0.7570 -1.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -1.2868 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -2.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2711 -3.8849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -2.5737 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 -3.8687 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8710 -2.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 -5.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2851 -6.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0281 -5.1798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7710 -3.8605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5280 -5.1555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5139 -2.5575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0139 -2.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9022 -3.7581 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3262 -3.2868 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3181 -1.7869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8890 -1.3311 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.5268 -0.8986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9004 -1.5013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1092 -0.6131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9443 0.8778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5707 1.4805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3620 0.5923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1530 1.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 0.6056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6056 1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.6056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3684 -1.7115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9718 -2.4756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8514 -0.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1084 -1.5312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -6.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2491 -7.0723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8907 -7.5027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 -5.8611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0216 -3.9799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8281 -5.1863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0346 -6.3798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9083 -1.5215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0323 -2.6940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2080 -1.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4388 2.6732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2631 1.0744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8636 0.7991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1200 2.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4425 2.7330 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 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 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 41 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END