IFLAB-ZINC04941592 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.0740 1.5090 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.1260 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -0.5820 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.0960 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 1.4850 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 2.1870 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -0.6190 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.3010 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 -1.2570 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 -2.1650 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -1.7830 0.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1150 -3.3080 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 -2.7100 0.2460 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 -1.5380 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 0.7920 -1.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 0.7330 -2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 -0.3040 -2.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 1.9450 -3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 2.9820 -3.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 1.8870 -4.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 3.0760 -5.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8880 2.7420 -6.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1060 3.9830 -7.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0150 3.6720 -8.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 2.0600 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -0.4010 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.6610 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 2.0150 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 3.2660 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 -3.4760 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -4.2180 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 -2.0000 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -0.6220 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 1.5950 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1610 1.0580 -4.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9620 3.3960 -5.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3300 3.8770 -4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8400 2.4210 -6.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4730 1.9400 -7.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 4.3040 -7.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 4.7850 -6.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2000 4.4140 -9.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 14 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 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M END