IFLAB-ZINC05153420 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5890 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.2970 -2.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -0.2740 -1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -2.2400 -1.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -2.9090 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -2.5490 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -3.2110 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -4.2460 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -4.5940 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -3.9270 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -5.6960 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -5.9540 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -5.0500 -1.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8830 -4.9160 -2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9780 -5.4270 -2.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 -4.1150 -3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 -2.8780 -3.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -2.7440 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -1.7560 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.1930 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -6.5950 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -5.3720 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -6.9890 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -5.7300 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -4.7510 -4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -3.8000 -4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 -2.1230 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -2.4800 -4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 M END