PUBCHEM-ZINC03112655 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.7540 -1.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0200 -3.8700 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -5.9480 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -6.1220 -2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -6.9290 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -7.0890 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -6.4440 -3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -5.6380 -4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -5.4810 -3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -4.5030 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 -4.5600 0.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -4.2150 -1.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0710 -3.9820 -1.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0170 -3.7050 -1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3870 -3.4600 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4080 -3.1610 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6880 -2.9330 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9670 -2.9980 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9660 -3.2920 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6760 -3.5300 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6930 -3.8250 0.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0610 -3.8800 2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 -4.2180 3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0460 -3.2070 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -3.5170 4.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 -4.8380 4.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 -5.8490 4.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -5.5380 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -6.8490 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -5.7700 -2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -7.4330 -1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -7.7190 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -6.5680 -4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -5.1330 -5.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -4.8540 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -4.1700 -2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 -3.6540 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1940 -3.1080 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4770 -2.7020 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9730 -2.8180 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1920 -3.3410 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4550 -2.9120 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8240 -4.6450 2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2860 -2.1750 3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -2.7280 4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -5.0800 5.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -6.8800 4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1760 -6.3280 2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 18 19 2 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 20 54 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 55 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 38 2 0 0 0 0 37 65 1 0 0 0 0 38 39 1 0 0 0 0 38 66 1 0 0 0 0 39 67 1 0 0 0 0 M END