IFLAB-ZINC05241768 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8460 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.5740 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -2.4240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -2.7460 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 -3.2630 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 -3.3730 -0.7380 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -2.7090 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -2.4920 -2.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -2.8080 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -3.2850 -3.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 -2.5760 -4.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -2.9030 -5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -2.6830 -7.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -2.1400 -7.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -1.8140 -6.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -2.0230 -5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -1.8620 -9.0510 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -1.9140 -8.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -2.8110 -9.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -0.1770 -9.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 0.1860 -10.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 -3.6930 2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -3.8340 3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -2.5670 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -2.5230 2.6340 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 0.5120 -0.3560 -0.8950 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 -2.2250 -2.1110 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1680 -3.3280 -5.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 -2.9360 -8.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -1.3900 -6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -1.7640 -4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -0.1230 -9.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 0.5220 -8.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 1.1990 -11.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 0.1320 -10.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -0.5130 -11.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -2.9410 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 -4.6510 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7330 -3.9660 4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 -4.6980 3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -1.6890 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -2.5780 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -3.3080 2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -1.5500 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END