PUBCHEM-ZINC05649798 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.1250 -2.0040 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.6040 -1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 0.3290 -1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 0.1860 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 0.1790 -2.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 1.6820 -2.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 2.0130 -4.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 3.4560 -3.9950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 3.7780 -4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 3.9280 -6.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 3.7530 -6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 3.9040 -8.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 4.2310 -8.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 4.4080 -8.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 4.2610 -7.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4570 4.2940 -5.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 3.9630 -4.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 3.8230 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 4.0060 -2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1580 4.3320 -3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 4.4750 -5.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 3.4770 -2.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0950 2.5000 -1.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 4.1700 -2.0230 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2690 -1.4800 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -1.7380 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -3.0800 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -1.8540 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -2.1410 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 1.3780 -2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -0.2560 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 0.7710 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -0.8630 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 0.5470 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -0.3710 -2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -0.0910 -3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 1.9680 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 2.2300 -3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 1.7270 -4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 1.4650 -3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 3.9870 -4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 3.5000 -6.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 3.7690 -8.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 4.3460 -10.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 4.6610 -9.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 3.8980 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1900 4.4720 -3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5460 4.7270 -5.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -0.1580 -1.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 4.4320 -6.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 49 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 50 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END