PUBCHEM-ZINC04537016 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 71 0 0 1 0 0 0 0 0999 V2000 1.1860 1.1740 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.2980 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.9150 0.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -0.9280 -1.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -2.3600 -1.2690 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2330 -2.6100 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -2.7000 -2.6040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4220 -2.4030 -3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -4.2100 -2.6680 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9060 -4.4680 -3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -4.9470 -2.4800 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5260 -4.6890 -3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -4.5620 -1.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -3.1680 -1.1350 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4220 -2.8870 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -2.8980 0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -3.4230 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 -3.0760 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -3.7420 1.8410 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 -3.2370 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7530 -3.7320 3.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1370 -3.3120 5.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3600 -2.6820 5.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3440 -3.6380 5.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6460 -3.2010 7.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -6.4560 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -7.1460 -2.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -4.5880 -1.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 -4.6940 -2.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0250 -3.7980 -2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -4.8420 -0.8360 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5790 -3.9500 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 -5.0170 -1.3040 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4240 -4.1220 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -6.2280 -2.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2000 -6.3260 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -6.0260 -3.4070 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5130 -5.1470 -3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -5.8400 -2.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -7.2590 -4.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -7.0240 -5.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -7.4100 -1.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9510 -5.2270 -0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -5.9870 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -2.0030 -2.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 1.3110 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 1.6600 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 1.6180 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -0.4350 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -4.5060 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -2.9880 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -1.9930 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -3.5110 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3090 -2.1500 3.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 -3.6680 4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7820 -4.8190 3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4530 -3.3010 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5940 -2.1140 7.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9230 -3.6320 7.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6490 -3.5300 7.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -6.7260 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.7360 -3.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -8.1090 -2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 -8.1210 -3.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 -7.4530 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -7.7660 -6.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3990 -7.5970 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -4.5000 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -5.9460 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -1.0410 -2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 45 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 39 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 44 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 43 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 42 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 40 41 1 0 0 0 0 40 64 1 0 0 0 0 40 65 1 0 0 0 0 41 66 1 0 0 0 0 42 67 1 0 0 0 0 43 68 1 0 0 0 0 44 69 1 0 0 0 0 45 70 1 0 0 0 0 M END