PUBCHEM-ZINC01001105 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 57 0 0 1 0 0 0 0 0999 V2000 -0.0280 1.6100 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 0.2220 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -0.4980 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 0.1680 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 1.5760 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 2.2850 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 1.9580 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 0.8210 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 -0.2570 0.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -1.1840 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 0.7950 -0.0410 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4080 0.1070 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4740 2.1610 0.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 3.2860 -0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 3.3500 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5430 2.3740 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8680 3.5090 1.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3210 1.2280 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5020 0.0920 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2290 -0.9750 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7770 -0.9190 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 0.2040 3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8810 1.2800 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5550 -2.0670 3.0120 N 0 3 0 0 0 0 0 0 0 0 0 0 10.7120 -3.0570 2.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0380 -2.0210 4.1290 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3740 0.3640 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 1.2490 -2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3830 0.8580 -3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0890 -0.4220 -3.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 -1.3120 -3.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -0.9160 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 -2.4950 -3.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1780 -2.4530 -4.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3280 -1.0460 -5.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 2.1600 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -0.2980 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -1.5780 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 3.3650 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2870 4.2170 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7310 3.1370 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 3.9900 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 3.7510 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 0.0470 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3700 -1.8550 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0300 0.2410 4.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7480 2.1590 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 2.2470 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8920 1.5510 -4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5770 -1.6060 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 -2.8940 -4.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 -2.9640 -5.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 50 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 51 1 0 0 0 0 34 52 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END