PUBCHEM-ZINC06182846 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 0 0 0 0 0 0999 V2000 0.3870 1.6230 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 0.1330 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -0.7300 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -0.7210 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -1.9190 3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -3.1740 2.0250 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -2.0240 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -1.9410 -0.6280 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.6040 -1.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.2660 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -2.9930 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -2.8750 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -3.9360 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -5.1150 -3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -5.2400 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -4.1840 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -2.1570 4.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -1.2400 5.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -3.3860 5.1590 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0530 -3.5770 6.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -2.4800 7.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -2.6930 8.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -4.0020 9.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -5.0450 8.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -4.8390 7.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -5.5970 6.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -4.4440 4.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -5.1610 3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -6.2250 2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -6.5410 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -5.7900 3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -4.7830 3.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 1.8380 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 2.0920 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 2.0180 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 0.1820 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -1.9540 -2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -3.8450 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -5.9430 -3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -6.1630 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -4.2800 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -1.4770 6.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -1.8590 9.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -4.1810 10.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -6.0520 8.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -4.8880 4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -6.7980 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -7.3670 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 -6.0340 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 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 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 30 31 2 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 M CHG 1 8 1 M CHG 1 19 1 M END