IFLAB-ZINC04087166 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.0520 1.4060 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -0.0600 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -0.2640 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 0.6800 1.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -1.6160 1.4670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -2.1950 2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -3.5640 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -3.8120 4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -2.6280 4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -1.2570 3.8340 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -2.5070 5.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -4.9790 5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -5.1280 4.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -3.8830 7.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -2.9670 9.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 -3.5430 7.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -4.5130 1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -4.1920 0.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -5.7610 2.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.9170 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 1.5080 -1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 1.9200 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -0.5490 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -0.5530 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -2.2930 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -2.1980 5.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -1.7950 6.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -5.9020 6.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -4.7330 5.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -5.5530 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -5.8320 3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -4.9140 8.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -1.9100 8.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -3.1880 9.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -3.1070 10.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 -3.6810 8.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 -4.1920 6.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 -2.5030 7.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -6.0710 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -6.4190 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -3.8480 6.7130 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5820 -4.0220 7.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 41 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 14 41 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 41 1 M END