PUBCHEM-ZINC05115946 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.4780 -2.4300 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -2.5380 0.5560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9340 -3.4400 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -2.5560 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -2.5470 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 -1.4100 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -1.3830 4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -2.4900 5.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -3.6250 4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -3.6570 3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -1.1430 0.9270 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7470 -1.1800 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 0.2510 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 1.3350 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 1.0630 0.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 2.2110 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 2.3880 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.2070 0.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 4.1730 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 2.6610 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 3.2520 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -2.2110 1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -2.8320 2.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7260 -2.3790 1.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 -3.2260 1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 -3.8440 2.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 -3.2390 0.8570 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4830 -2.2530 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 -3.6620 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2290 -4.2780 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6890 -4.8290 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5740 -5.6470 0.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9450 -4.2090 1.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -2.5570 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -3.2150 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -1.4630 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -1.7000 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -3.4490 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -0.5350 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -0.5000 5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -2.4700 6.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -4.4900 5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -4.5570 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 0.2500 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 0.4770 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -1.8590 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -4.4180 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 -2.8260 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1420 -5.0690 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9420 -3.5180 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0580 -4.4250 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -1.3690 1.1880 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6270 -0.4650 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -1.4520 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 52 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 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 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 11 52 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 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 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END