MMs00186838 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -1.5000 0.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2419 1.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4838 2.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0162 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7581 1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7742 3.8924 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2742 3.8831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0323 5.1961 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7419 1.3223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 2.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0454 2.0867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0547 0.5867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6311 0.1143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2737 -0.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6402 0.3312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9439 -0.4107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1100 -1.9015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0523 0.5999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4337 1.9664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9430 1.8003 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.1756 3.2701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4176 4.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1595 5.8681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6595 5.8774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4175 4.5831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6756 3.2794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5935 -1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1064 -1.0262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0773 3.6503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 1.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2381 3.6802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0118 2.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1557 -1.4816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5031 3.7874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4936 5.3300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0293 6.2715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3605 7.0511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3320 5.3601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3416 3.8174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4746 2.0963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8058 2.8760 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 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 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 25 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 27 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END