PUBCHEM-ZINC05965772 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.0450 -5.8200 5.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -4.8770 4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -4.8760 2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -3.9090 1.8780 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4960 -4.1410 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -5.2560 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -5.1290 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -3.9420 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -2.8250 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -2.9700 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -2.0980 0.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -1.1590 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -2.6640 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -1.9960 2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -1.3160 4.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -1.0560 5.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.5870 5.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -0.8490 4.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 0.3620 7.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.8100 7.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 2.4040 6.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 3.3580 6.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -6.8470 4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -5.8090 6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -5.5210 5.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -3.8650 4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -5.1740 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -5.8690 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -4.6340 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -6.1660 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 -5.9710 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 -3.8930 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 -1.9070 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -1.0510 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -2.6600 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -2.0680 4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -0.3940 3.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -0.6050 6.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -1.9750 6.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -1.5000 6.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 0.1820 5.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 0.1070 3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -1.2540 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 -0.3200 8.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 0.3320 7.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 2.3640 8.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 1.8550 7.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -1.7940 3.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -0.0880 6.1330 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5890 0.8220 5.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 48 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 49 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 17 49 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 4 1 M CHG 1 49 1 M END