IFLAB-ZINC05239535 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 1.0150 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.0270 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 3.4810 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 4.9440 2.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 5.6340 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 6.9160 1.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 7.4410 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0710 8.7980 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 9.1450 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 8.1690 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 6.8390 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 6.4680 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 4.8830 0.6480 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 5.6210 3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 6.8320 3.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 4.8710 3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 6.0520 4.9070 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 5.0090 5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 5.5640 6.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 4.7440 7.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 3.3700 7.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 2.8130 6.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 3.6280 5.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 2.3420 8.0030 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.3320 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.0740 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.3810 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 3.4080 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 3.4130 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 3.0950 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 3.1000 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 9.5690 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 10.1870 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 8.4530 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1110 6.0800 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 4.2100 4.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 4.2800 3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 6.6370 6.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 5.1760 7.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 1.7410 6.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 3.1930 5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 46 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 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 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 M END