PUBCHEM-ZINC05434545 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 0.3390 2.5300 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 1.5090 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 2.0720 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 1.2650 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 0.2160 -0.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 0.0800 -1.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6720 1.0500 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -0.5280 -2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 0.4570 -3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 1.4170 -4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 2.3140 -5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 2.2560 -5.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 1.2990 -5.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 0.4010 -4.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -1.0110 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 -2.1330 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -1.7310 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -0.6380 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4880 -2.9510 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9070 -2.5020 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5780 -3.5520 3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 -4.6340 3.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9160 -3.2690 4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4660 -4.2080 4.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7170 -3.9860 5.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4250 -2.8260 5.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8860 -1.8890 4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6320 -2.1070 3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 2.7600 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 2.1550 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 3.4750 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 3.0430 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 1.3980 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 2.2060 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 0.8540 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 0.5260 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 2.1850 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -1.0090 -3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -1.3270 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 1.4710 -3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 3.0560 -5.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 2.9540 -6.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.2520 -6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -0.3380 -4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -1.2490 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -0.0710 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -2.1540 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -3.1130 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 -2.7060 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2540 -1.4560 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 0.3360 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 -0.5950 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -3.8650 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -3.1290 3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4970 -2.3770 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 -1.5550 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9260 -5.1200 5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1390 -4.7170 6.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4000 -2.6520 5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4460 -0.9860 4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2520 -1.3540 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -0.8990 -0.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -1.8770 1.5580 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8920 -0.9770 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 62 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 62 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 63 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 17 63 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 18 62 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 19 63 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 28 61 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END