PUBCHEM-ZINC06495194 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.0300 1.3350 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.1330 -0.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7510 -0.6390 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -0.2520 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -0.6810 2.4980 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8870 -1.7260 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -0.3930 1.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2180 0.6930 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -0.8030 -0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8490 -0.4380 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -2.3220 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -0.9950 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -0.3430 2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 0.3070 3.6280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9870 1.2800 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -0.5380 3.8180 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2940 -1.5350 4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 0.4620 6.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9570 1.1230 6.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 1.2770 5.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6740 2.2070 5.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 0.6330 4.9650 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7690 1.4090 4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 -0.5470 5.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 1.7350 7.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -0.7790 7.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.7840 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 1.4060 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 1.9440 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -1.2850 1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 0.3550 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -2.7980 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -2.7960 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -2.5500 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 -0.8770 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 -2.0730 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 0.4290 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 -1.1150 2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2470 -1.4810 5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 -0.3640 6.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 -0.7120 4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 2.3230 7.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 2.3720 7.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 0.9010 7.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -1.5600 6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -1.2170 7.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -0.5330 8.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.1840 2.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 1.1450 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 0.0790 4.8430 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3270 -0.5520 4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 0.8850 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 5 48 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 18 50 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END