PUBCHEM-ZINC06625896 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.4360 1.3820 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -0.0390 0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -0.9620 1.1420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8890 -1.1450 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -2.2400 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -2.1680 -0.9550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5210 -2.5920 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -0.6760 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.1690 -2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -2.8490 -0.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -0.4560 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -0.0050 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 0.4620 2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 0.4760 4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 0.0420 4.4350 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7680 -0.4280 3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 0.0810 5.8850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1850 0.1970 5.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 -1.2590 6.5860 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9740 -2.0210 6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -1.1040 8.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2440 -1.0650 8.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 0.1750 8.7020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7300 0.2550 9.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 1.3690 7.8930 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3580 1.4120 7.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 1.2500 6.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 2.6930 8.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 3.4520 7.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 0.0800 8.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -0.4330 7.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -2.2690 8.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 -2.4710 8.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 -1.5130 6.5010 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2030 1.5200 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 1.8430 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.8610 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -3.1360 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -2.2560 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -2.7290 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -0.0050 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 0.8120 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 0.8240 4.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -0.7740 3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 2.9050 9.6870 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 10 40 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 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 15 1 M CHG 1 34 -1 M CHG 1 45 -1 M END