PUBCHEM-ZINC05159300 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 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 3 0 0 0 0 0 0 0 0 0 0.5150 -0.3400 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -0.4860 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -1.2160 2.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -0.7120 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -0.5710 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 -0.0510 3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 0.3190 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 0.1740 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -0.3330 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -0.4910 -0.0340 N 0 3 3 0 0 0 0 0 0 0 0 0 -2.0380 0.0600 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 0.5560 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 0.5390 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 0.8070 0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8710 1.1090 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 1.1160 -3.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -1.9300 -0.2890 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.6590 0.0900 4.9720 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -0.9500 4.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -2.0010 5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -2.4440 6.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.2340 6.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 0.2090 5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -1.6850 8.6870 C 0 0 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 1.5960 -1.1280 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 0.3760 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8430 0.7190 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 0.0940 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -1.6130 5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -2.8530 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -3.2040 7.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.8580 6.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -0.6220 6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 0.6180 7.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 0.9680 4.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 0.6220 5.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -2.1270 8.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -2.4150 9.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -0.8090 9.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 1.6040 -2.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -1.2860 7.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 1.9550 -3.1720 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 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 46 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 12 1 M CHG 1 19 -1 M END