IFLAB-ZINC05152943 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -1.0230 1.3930 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -0.0210 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -0.3260 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -1.6260 1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -2.6430 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -2.3480 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -1.0410 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -0.7560 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -4.0040 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -4.1740 1.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -5.0690 0.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -6.4630 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -6.9850 2.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3600 -6.5600 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -8.4750 2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -9.3350 2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -10.6450 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -10.5030 1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -9.1890 1.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 -7.0550 2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -6.1720 3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -5.8210 4.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -5.3650 5.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -5.0080 6.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -5.0950 7.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -5.5350 6.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -5.8900 5.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -6.3870 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 1.8010 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 1.4270 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 2.0470 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 0.4510 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -1.8330 2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -3.1180 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -0.0290 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -1.6610 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -0.3690 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -4.8920 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -7.0480 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -6.5670 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -9.0560 3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -11.5800 2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -11.2020 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -7.1390 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -8.0530 2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -6.6980 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -5.2400 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 -5.2850 4.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8150 -4.6590 7.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -4.8190 8.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -5.5950 6.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -7.4040 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -5.7280 4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -6.4300 2.8590 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7900 -5.4220 2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 8 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 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 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 54 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END