NCID-ZINC01698207 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 0.0160 1.5260 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.0220 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.7120 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -2.1090 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.8170 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.0750 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.6640 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 0.0780 -2.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 0.9880 -2.7690 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.8040 -2.5170 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0240 -3.4670 -2.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -2.7890 -3.1760 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0570 -4.3200 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.9230 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 1.9470 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 1.8740 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -0.1930 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -2.6370 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -4.7130 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -4.7190 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -4.6960 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -0.2770 -3.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 22 2 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M END