IFLAB-ZINC05250767 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 0 0 0 0 0 0999 V2000 -0.0230 1.0870 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 1.0070 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 3.0270 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 3.4800 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 4.9440 2.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 5.5720 3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 4.9250 4.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 7.0640 3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 7.7120 2.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 7.6920 4.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 9.0850 4.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 9.8670 3.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 11.2430 3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 11.8420 4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 11.0660 5.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 9.6900 5.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 13.3170 4.7510 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9460 14.0020 3.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 13.8460 5.8430 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.0030 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.4590 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.4530 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 1.3200 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -0.0820 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 1.3730 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 3.4130 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 3.4070 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 3.1000 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 3.0940 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 5.4620 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 7.1780 4.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 9.4000 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 11.8520 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 11.5370 6.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 9.0850 6.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 1.5590 1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 36 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 8 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 31 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END