IFLAB-ZINC02457542 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 0.2730 1.3290 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -0.0020 0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -0.5070 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 0.3930 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 1.7270 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 2.2130 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 3.6510 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 3.9770 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 5.4230 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 6.4090 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 6.0910 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 4.6480 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -1.8210 1.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -2.5640 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -3.9260 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -4.6580 1.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -3.9070 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -2.5550 2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -5.9390 1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -6.5020 1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -6.6090 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -7.9970 3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -8.6090 4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -9.9870 4.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -10.8960 3.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 1.6610 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -0.6520 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 0.0750 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 2.3770 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 3.7820 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 3.8160 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 3.3010 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 5.6400 -2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 5.5530 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 6.3780 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 7.4280 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 6.7770 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 6.2610 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 4.4450 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 4.5340 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -2.0270 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -2.7110 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 -3.7800 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -4.5040 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -3.7500 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -4.4640 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -2.7280 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -1.9950 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -5.9710 3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -6.6920 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -8.6440 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -7.9320 3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -7.9730 4.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -8.7120 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -10.0510 5.5580 O 0 5 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 M CHG 1 55 -1 M END