PUBCHEM-ZINC02043400 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 0.1080 0.6660 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -0.6400 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -0.9120 -0.6970 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5010 -0.7770 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.1210 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.3800 -1.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5220 -3.0730 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -2.6420 -1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -2.4890 -2.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -2.4080 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -3.3200 -3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 -2.8710 -3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 -3.7590 -4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0530 -4.9990 -4.5480 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8550 -5.4680 -4.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -4.6490 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -5.0630 -3.0510 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5410 -6.8920 -4.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 -1.4960 -3.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 -1.2790 -3.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7620 -1.6220 -2.7440 P 0 0 0 0 0 0 0 0 0 0 0 0 7.6040 -3.1170 -2.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 0.7060 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 1.5340 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 0.7540 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -1.4580 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -0.6210 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 0.1630 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 1.1230 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -0.0990 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -2.5380 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -1.3600 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4730 -3.5260 -4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 -5.6210 -5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -7.4910 -3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -6.9430 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 -7.3440 -5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 -0.7450 -3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 -1.3400 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -2.9870 -0.5820 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1230 -2.7090 -2.3290 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1160 -3.7650 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -2.3930 -3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9830 -1.2550 -3.5670 O 0 5 0 0 0 0 0 0 0 0 0 0 7.4940 -0.7400 -1.5340 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 41 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 M CHG 1 14 1 M CHG 1 17 -1 M CHG 1 40 -1 M CHG 1 41 1 M CHG 1 44 -1 M CHG 1 45 -1 M END