IFLAB-ZINC05250786 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 0 0 0 0 0 0999 V2000 -0.0350 1.4250 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.0040 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -0.5700 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -2.0960 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -2.7030 -2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -4.1640 -2.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -4.9160 -3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -4.3820 -4.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -6.4060 -3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -6.9400 -2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -7.1570 -4.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -8.5460 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -9.2260 -3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -10.5990 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -11.2970 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -10.6240 -4.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 -9.2510 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -12.7690 -3.4580 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6750 -13.3640 -2.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -13.3850 -3.8960 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9860 1.8070 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 1.7810 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.7770 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -0.2550 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -0.2300 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -2.4110 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -2.4370 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -2.3880 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -2.3620 -2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -4.5910 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -6.7330 -4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -8.6810 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -11.1280 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -11.1720 -4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 -8.7260 -4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 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 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END