IFLAB-ZINC04568831 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 0.2950 1.4160 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 0.9630 2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 1.3160 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 3.6420 2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 3.2160 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 3.2300 4.9890 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7690 3.0670 4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 2.3140 6.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 2.7690 7.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 3.3290 8.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 3.3820 8.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 3.8730 9.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 3.7890 10.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 4.3120 11.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 4.9340 11.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 5.0310 10.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 4.5060 9.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 5.4060 12.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 6.0550 12.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 4.7080 5.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 5.2050 5.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 6.5660 6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 7.4100 5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 6.9410 5.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 5.6050 5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 7.9330 5.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 9.0830 5.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 8.7550 6.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 0.3650 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 1.5650 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 2.0050 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 1.0720 2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -0.0940 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 1.1180 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 0.7370 4.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 4.6860 2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 3.5180 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 3.8230 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 3.4450 1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 1.3140 6.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 2.2060 6.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 2.6600 7.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 3.3170 11.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 4.2390 12.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 5.5200 10.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 4.6290 8.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 5.3710 12.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5350 6.3650 13.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1710 6.9550 12.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 4.5320 5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 6.9460 6.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 5.2780 4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 9.7840 4.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 9.5740 6.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.7920 1.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 2.7940 3.7610 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0980 2.9680 3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 55 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 55 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 56 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 55 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 56 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 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 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 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 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END