IFLAB-ZINC02713769 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7310 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.4330 0.6660 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0020 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7120 -1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.9030 -2.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.2280 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.6340 -0.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -5.2060 -2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.8960 -2.3020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -7.8020 -3.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -7.2990 -5.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -8.2480 -5.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -9.4030 -5.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -9.1610 -3.9450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -10.1540 -2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -10.7560 -5.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -11.1880 -6.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -11.8140 -5.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -12.0340 -5.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -11.5340 -7.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -11.0190 -7.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -10.3850 -8.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.3440 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.5780 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -5.0620 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -5.0380 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -10.4190 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -11.0450 -3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -9.7360 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -11.4810 -5.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -10.6960 -6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -12.0940 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 -12.5140 -5.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -11.5450 -7.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -9.3160 -8.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -10.8240 -9.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -10.5440 -8.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END