PUBCHEM-ZINC05139773 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.5050 1.7460 -1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 0.2810 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -0.3890 -1.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -1.7350 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -2.5990 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -3.9670 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -4.5220 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -3.6550 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -2.2890 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4810 -4.0780 -0.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 -5.4200 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0290 -5.7990 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 -7.2150 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6020 -7.6930 0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7780 -6.8330 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3180 -6.6420 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3000 -8.1940 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -7.8070 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -6.3930 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -5.9830 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -6.9900 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -7.2450 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -8.1950 -1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -8.9140 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -8.6800 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -7.7180 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -7.5550 2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -6.3760 2.6800 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4560 2.2580 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 1.8520 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 2.2530 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -0.1880 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 0.2150 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 0.1590 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -2.2310 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.5870 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -1.6600 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8120 -5.0580 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5430 -7.3290 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5920 -5.8710 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2320 -6.0410 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5910 -6.1350 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5540 -7.6070 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5670 -9.2400 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -8.5770 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -6.7040 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -8.3790 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -9.6610 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -9.2580 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -8.6230 2.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 50 2 0 0 0 0 M CHG 1 28 -1 M END