PUBCHEM-ZINC05733340 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 60 0 0 1 0 0 0 0 0999 V2000 1.1900 0.1010 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -1.0540 1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -2.2470 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -0.6060 1.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7000 0.2130 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -0.2140 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -1.0880 2.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 1.1090 2.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 2.2190 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 3.4540 2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 3.0980 2.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0020 3.6950 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 1.5960 3.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1560 1.5260 4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 0.9000 2.8270 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6600 1.6590 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -0.1620 3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 0.4000 5.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 1.6550 5.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 0.3470 1.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 1.0310 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 3.2430 1.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 4.4980 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 5.5040 1.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7200 4.4730 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -1.6790 0.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -1.9950 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -1.4310 -1.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -3.0390 -1.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -3.6080 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -4.2000 -2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -4.7490 -2.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -2.5830 -3.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -0.2270 2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 0.9190 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 0.4930 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -1.3790 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -1.9810 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -3.0860 2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -2.6040 2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 2.1190 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 2.2290 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 3.5720 3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 4.3550 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1810 -0.6350 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -0.9710 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 3.7910 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 5.4750 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 4.1660 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -2.2270 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -4.8620 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -4.7700 -3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -3.4230 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -4.3680 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 -5.2650 -3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -5.4850 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -1.7780 -3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -3.0500 -4.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -2.1090 -3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 -0.4700 6.1510 O 0 5 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 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 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 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 60 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 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 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 M CHG 1 60 -1 M END