PUBCHEM-ZINC02005405 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 0 0 0 0 0 0999 V2000 -2.4810 1.6220 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 0.4550 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.1900 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.7930 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -1.9810 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -2.5990 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -4.0070 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 -4.6130 0.9550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -5.8950 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -6.6690 1.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 -6.3520 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 -5.5700 0.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 -7.6400 1.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 -8.2320 1.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 -9.4440 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2930 -10.2200 2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5120 -11.5130 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8910 -11.7840 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4170 -10.6370 1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4700 -9.6780 1.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7450 -10.3050 1.5490 N 0 3 0 0 0 0 0 0 0 0 0 0 -12.5980 -11.1880 1.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9500 -9.1780 1.0820 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8510 2.3450 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 2.1490 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 1.2850 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 0.7660 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -0.0240 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -0.5250 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 0.9000 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -0.4570 -2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -0.4810 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -1.8870 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -1.9000 1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -2.5850 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -1.9870 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -2.6360 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -4.6530 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -3.9940 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8050 -4.1120 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 -8.1330 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 -9.9390 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7630 -12.1810 3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4260 -12.6950 2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -0.5780 -0.1510 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.5880 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 45 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 45 1 0 0 0 0 6 7 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 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 45 1 M END