PUBCHEM-ZINC06177580 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 0 0 0 0 0 0999 V2000 0.2090 1.3030 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -0.2010 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -0.9310 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -2.3170 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.9690 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -2.2460 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.8580 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 0.2810 -3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 0.9710 -4.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 1.3960 -5.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 2.0400 -6.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -2.9480 -2.6240 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2200 -4.1540 -2.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.3200 -3.6250 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4200 -3.0970 2.2640 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3920 -4.3140 2.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -2.5210 3.3120 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2580 -0.2730 2.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 0.0460 2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 0.6490 4.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 0.9820 4.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 2.1090 6.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 2.7540 8.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 1.7830 9.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 1.2280 8.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 0.5680 7.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 1.6050 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 1.7220 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 1.6690 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -4.0470 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 0.9720 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -0.5980 -3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 1.8500 -4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 0.2800 -5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 0.5160 -5.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 2.0870 -4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 2.3370 -6.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 0.5580 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -0.8640 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 0.7640 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 1.5600 4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -0.0680 4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 0.0710 5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 1.6990 4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 2.8600 6.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 1.3070 6.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 3.1120 8.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 3.5910 8.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 0.4830 9.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 2.0210 8.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -0.2590 7.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 0.1940 6.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 1.5610 6.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.1270 -2.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 0.6730 -2.2690 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 18 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 15 1 M CHG 1 17 -1 M END