PUBCHEM-ZINC01085500 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8260 -2.4140 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -2.5720 1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -2.5840 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -3.3780 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -3.8570 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4100 -3.5410 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -2.7440 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -2.2720 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6810 -4.0100 -0.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5930 -3.6440 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9430 -4.2520 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1080 -4.9310 -0.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9680 -4.0400 1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2230 -4.6040 0.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.2160 -4.3990 1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4850 -4.9700 1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6200 -4.8360 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6330 -5.5620 1.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0950 -6.1000 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8060 -5.7370 0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.8520 -6.9890 -0.5160 N 0 3 0 0 0 0 0 0 0 0 0 0 -17.0280 -7.2530 -0.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.2680 -7.4220 -1.4940 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -3.6620 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -2.1950 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -2.2210 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -3.6240 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 -4.4770 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7760 -2.4960 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -1.6560 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2220 -4.0110 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6840 -2.5580 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8360 -3.4960 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0690 -3.7940 2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7060 -4.2810 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6520 -5.6730 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END