IFLAB-ZINC04568863 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 0.8820 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 0.8940 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 1.4450 3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 3.4660 2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 2.9150 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 3.4780 4.8790 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6560 3.2320 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 2.8900 6.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 3.3840 7.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 3.0840 8.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 2.4050 8.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 3.5820 9.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 3.2730 11.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 3.7390 12.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 4.5140 11.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 4.8230 10.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 4.3670 9.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 4.9680 12.9860 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 4.9750 4.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 5.5340 4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 6.9070 4.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 7.7270 4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 7.1640 5.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 5.7870 5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 8.1700 5.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 9.3630 4.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 9.0850 4.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -0.2000 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 1.1180 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 1.3090 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 1.1780 2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -0.1930 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 1.1380 3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 1.0580 4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 4.5530 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 3.1820 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 3.3010 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 3.2220 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 1.8030 6.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 3.1930 6.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 3.9250 7.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 2.6700 11.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 3.5010 13.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 5.4260 10.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 4.6120 8.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 4.8960 4.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 7.3410 4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 5.3480 5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 9.5260 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 10.2260 5.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 1.4470 1.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 2.9130 3.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 51 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 52 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 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 44 1 0 0 0 0 17 45 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END