PUBCHEM-ZINC05985960 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.6320 0.9700 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 1.7230 3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 3.3370 1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 3.5580 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 4.9670 0.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 5.8530 -0.5390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1230 5.8710 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 7.2130 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 8.3810 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 9.6890 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 10.6290 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 11.8620 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 12.2130 0.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 11.2890 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 10.0310 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 8.4180 -1.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 7.0220 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 7.8390 1.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 5.5910 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 5.1200 2.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 5.3700 -1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 5.2290 -2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 4.7660 -4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 4.4370 -4.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 4.5880 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 5.0530 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 3.9400 -5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 3.8400 -6.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 3.6120 -5.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 3.1170 -7.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -0.0460 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 1.3190 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 0.9970 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 2.0560 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 0.6700 3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 2.3310 3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 3.6660 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 3.8950 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 3.1670 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 3.0220 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 10.4120 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 12.6240 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 11.5970 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 9.3340 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 9.3270 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 5.4850 -2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 4.6660 -4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 4.3530 -3.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 5.1560 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 3.8770 -7.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 2.1970 -7.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 2.8890 -7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 1.8780 1.9620 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6090 1.5570 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 53 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END