PUBCHEM-ZINC01853595 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.8440 0.8910 2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 0.6970 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 2.9710 2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 3.7910 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 5.1540 1.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 5.4590 2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 4.5850 3.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 6.9280 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 7.4520 4.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 8.8740 4.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 9.5420 5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 10.9340 5.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 11.7080 4.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 11.0870 3.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 9.6780 3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 9.0270 2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 7.6860 2.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 9.8230 1.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 9.1030 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 6.5940 5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 6.1770 6.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 5.3740 7.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 4.9790 7.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 5.3890 6.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 6.1950 5.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -0.1020 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 0.8240 3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 1.5000 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 0.6670 2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -0.3050 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 1.1280 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 3.4370 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 2.8960 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 3.8380 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 3.3400 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 5.9490 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 8.9770 6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 11.4090 6.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 12.7920 4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 11.7160 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 8.4480 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 8.5340 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 9.8310 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 6.4770 6.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 5.0570 8.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 4.3540 8.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 5.0820 6.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 6.5090 4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 1.5500 1.9050 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0640 1.6020 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 49 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 9 20 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 37 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 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END