PUBCHEM-ZINC05674908 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.1630 0.5330 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 0.1490 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 0.8420 2.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3350 0.5750 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 0.5460 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 1.3240 3.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 1.1130 4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 1.9660 4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 2.6640 5.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9140 3.4310 6.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7360 3.5030 4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3960 2.8050 3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 2.0370 3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 2.2630 1.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 2.6790 2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 1.1570 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 1.7220 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 1.9850 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 2.9020 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 2.3600 2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 2.1030 2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -0.3990 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 0.3780 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 1.3210 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -0.8790 1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 0.1360 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 0.8610 4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -0.5190 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 1.3770 5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 0.0590 4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 2.6170 6.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1830 3.9710 6.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6440 4.1000 4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0380 2.8560 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9790 1.4930 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 0.1560 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 2.6570 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 1.0200 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 2.4340 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7150 1.0320 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 3.9020 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4090 3.0120 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 3.0720 3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0400 1.4260 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 1.6970 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 3.0620 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 0.9870 0.8850 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0260 1.9210 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 36 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 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 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 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 21 45 1 0 0 0 0 21 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END