IFLAB-ZINC04568853 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0180 0.8820 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 0.8940 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 1.4450 3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 3.4660 2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 2.9150 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 3.4780 4.8790 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6560 3.2320 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 2.8900 6.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 3.3840 7.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 3.0840 8.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 2.4050 8.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 3.5810 9.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 4.8170 10.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 5.2750 11.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 4.5140 11.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 3.2900 11.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 2.8200 10.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4670 1.6280 9.7190 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 5.5620 9.7900 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 4.9750 4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 5.5340 4.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 6.9070 4.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 7.7270 4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 7.1640 5.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 5.7870 5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 8.1690 5.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 9.3630 4.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 9.0850 4.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -0.1990 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 1.1190 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 1.3090 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 1.1780 2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -0.1930 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 1.1380 3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 1.0580 4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 4.5530 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 3.1820 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 3.3010 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 3.2230 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 1.8030 6.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 3.1930 6.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 3.9250 7.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 6.2290 11.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 4.8770 12.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 2.7020 11.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 4.8960 4.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 7.3410 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 5.3480 5.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 9.5260 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 10.2260 5.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 1.4470 1.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 2.9130 3.7150 N 0 0 0 0 0 0 0 0 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 1 51 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 2 51 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 52 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M END