IFLAB-ZINC02456829 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.6220 1.3170 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -0.1880 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -0.8730 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -2.2520 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -2.9480 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -2.2630 -1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -0.8830 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -3.0210 -3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -4.4520 -0.7240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7890 -4.7790 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -5.0460 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -6.3720 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -6.8150 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -6.0970 2.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -4.6330 2.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -4.2760 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -6.7620 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 -6.1670 4.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -8.2150 3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 -9.0450 3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -10.4020 4.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -10.9500 4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -10.1320 4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -8.7600 4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -10.7190 4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -10.0070 4.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 1.7390 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 1.6460 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 1.6530 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -0.3300 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -2.7880 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -0.3480 -2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -3.2640 -3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -2.4060 -3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -3.9410 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -4.7080 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -6.1340 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -4.7190 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -6.7040 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -6.8110 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -6.5760 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -7.8890 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -4.1840 3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -4.2640 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -3.1940 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -4.6360 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 -8.6230 3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -11.0390 4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -12.0130 4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -8.1220 4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -4.9070 0.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -12.0450 4.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -12.3830 4.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 51 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 17 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 45 1 0 0 0 0 16 46 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 52 53 1 0 0 0 0 M END