IFLAB-ZINC04173234 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6990 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0780 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0650 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2450 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -4.8570 1.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.9920 -1.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4730 -4.4060 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -5.2240 -1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -6.2820 -1.1550 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6890 -6.5480 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -7.7510 -1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -8.6910 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -8.3710 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -7.1480 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -9.9170 -0.6610 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -10.2330 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -10.8900 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6180 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5950 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -4.2640 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -5.8100 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -5.7640 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -5.8140 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -7.9620 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -9.0720 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -6.8920 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -10.7200 -2.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -10.9020 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -9.3140 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -10.7240 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -11.8990 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -10.7720 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 M CHG 1 13 1 M END