PUBCHEM-ZINC05854494 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 1.5920 -0.2090 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -1.3560 0.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -1.3730 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -0.3570 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -0.5090 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -1.6820 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -2.7100 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -2.5380 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 -3.8880 -0.5090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -4.1210 -0.6450 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5270 -4.9320 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 -2.9650 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -1.8920 0.3870 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5680 -1.0570 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7720 -1.5970 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6040 -2.9350 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 -3.6050 -3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 -3.9810 -4.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1780 -6.3500 -3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -5.9000 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 -5.8110 -6.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8070 -7.0980 -6.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 -8.2600 -6.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -9.4510 -7.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 -9.4840 -7.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 -8.3470 -7.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -7.1540 -7.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 -10.6260 -8.2020 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -0.3650 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 0.6910 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -0.0850 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 0.5670 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 0.3190 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -3.3250 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -4.6180 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -0.0940 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7190 -1.1480 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0570 -2.9700 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 -3.7490 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -3.6280 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -2.5710 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 -3.8790 -4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 -3.3550 -5.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -7.3590 -3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2720 -6.3280 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 -6.5640 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -6.0420 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 -4.9970 -6.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4410 -5.8480 -5.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6150 -8.2500 -6.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -10.3510 -7.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -8.3950 -8.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 -6.2690 -7.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 -4.4980 -1.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7580 -5.4240 -4.7470 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7380 -5.5050 -4.8460 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 54 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 54 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 55 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 55 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 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 13 1 M CHG 1 55 1 M END