IFLAB-ZINC04853878 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 -0.3280 2.3790 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.8400 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 1.7160 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 2.1300 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 2.6690 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 2.7930 -1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 3.1210 -0.4500 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6940 2.3870 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 3.3010 -1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 2.3440 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 2.9870 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 4.3170 -3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 4.5190 -2.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 5.8080 -1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 5.6250 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 4.4320 0.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 4.5580 1.7960 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 5.6650 2.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 3.2480 2.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3820 5.0060 1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 4.9030 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4430 5.2540 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 5.7090 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3320 5.8130 2.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9940 5.4660 2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 5.5820 4.1750 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7180 6.1050 5.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 5.1550 4.2280 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7140 2.0100 1.7310 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 2.4710 -2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 1.5180 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 1.2960 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 3.2130 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 1.2790 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 2.5050 -4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 5.0870 -4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 6.1720 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 6.5280 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 6.5030 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 5.4970 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 4.5470 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0080 5.1730 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1010 5.9830 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8110 6.1680 3.8010 H 0 0 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 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 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END