PUBCHEM-ZINC04626753 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.2510 1.4060 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -0.0110 -0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -0.5310 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 0.1890 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -0.4870 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -1.8690 3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -2.6190 2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -1.9230 1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -4.0320 2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -4.6050 3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -3.7730 4.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -2.4320 4.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -4.9550 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -5.1770 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -6.0490 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -6.1020 -2.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2170 -5.0720 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -6.6580 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -6.7770 -3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -7.0730 -4.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -6.9380 -3.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2460 -7.9480 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -6.3320 -3.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -6.9760 -3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 1.7970 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.6560 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 1.8760 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 1.2700 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 0.0890 3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -2.4630 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -5.6790 3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -4.1740 5.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -5.9200 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -4.5500 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -4.2150 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -5.6470 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -7.0640 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -5.6460 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 -6.0060 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 -7.6420 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -5.8040 -3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -7.2680 -2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -7.7720 -5.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -6.1110 -5.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -5.3070 -4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -6.4870 -4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -7.9950 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -7.6210 -4.0860 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3340 -7.7180 -4.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -8.5760 -3.7220 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 8 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 12 2 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END