PUBCHEM-ZINC04695068 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 0.0760 0.7520 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -0.6380 0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -0.9690 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -0.0780 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -0.4930 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -1.7980 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -2.1650 -1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -3.4480 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -4.3790 -2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -4.0280 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -2.7340 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -2.3140 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -3.2610 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -3.7520 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -3.4690 2.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -3.8600 3.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -3.3900 3.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -3.6740 2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -4.6000 4.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -4.9060 6.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -5.6250 7.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -6.0620 7.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -5.7140 6.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -4.9960 4.9560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 0.8480 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 1.3160 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 1.1580 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 0.9490 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 0.2280 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -1.4450 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 -3.7150 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -5.3820 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -4.8040 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -4.3150 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -3.0420 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -3.3090 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -4.8280 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -3.9830 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -2.3960 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -3.8490 4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -2.3090 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -4.7510 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -3.1830 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -5.8430 7.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -6.6370 7.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -6.0060 5.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -3.1390 1.4330 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4690 -2.1170 1.5710 H 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 3 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 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 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 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 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END