PUBCHEM-ZINC04190074 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 73 0 0 0 0 0 0 0 0999 V2000 12.0690 -0.8860 -9.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3540 -1.3030 -10.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9980 -1.3620 -10.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2420 -1.7590 -11.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 -1.8200 -11.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 -1.4830 -9.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9970 -1.0860 -8.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3730 -1.0310 -8.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -1.5440 -9.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3950 -1.1480 -8.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 -1.0520 -8.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -2.3240 -8.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -2.8550 -10.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 -2.8800 -10.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -2.9850 -8.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -2.6050 -7.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -4.1660 -8.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -4.4320 -10.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -5.6580 -10.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -6.1170 -9.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -5.2090 -8.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -5.3430 -6.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -5.7790 -6.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -5.9100 -4.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -5.6070 -3.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -5.1720 -4.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -5.0450 -5.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -5.7480 -2.5230 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0610 -6.1310 -1.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -5.4820 -1.8510 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4970 -6.3240 -11.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -5.7310 -12.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -6.3520 -13.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -7.5690 -13.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -8.1660 -12.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -7.5520 -11.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -8.1390 -10.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -9.3940 -10.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -8.1760 -15.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -7.5060 -16.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7520 0.1180 -8.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8640 -1.5750 -8.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1380 -0.8830 -9.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7300 -2.0210 -12.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2780 -2.1280 -11.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 -0.8240 -7.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9630 -0.7260 -8.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 -1.8930 -7.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8220 -0.1790 -8.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -0.8720 -7.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -0.2380 -9.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -3.8660 -10.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -2.2140 -11.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 -3.1660 -11.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 -3.6000 -9.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -3.8100 -10.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -6.0160 -6.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -6.2490 -4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -4.9360 -4.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -4.7100 -6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -4.7840 -12.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -5.8910 -14.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -9.1130 -12.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -10.1180 -10.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -9.7510 -9.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -9.2680 -10.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -8.0970 -17.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -6.5270 -16.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -7.3840 -16.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 45 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 54 1 0 0 0 0 14 55 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 27 60 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 61 1 0 0 0 0 33 34 1 0 0 0 0 33 62 1 0 0 0 0 34 35 2 0 0 0 0 34 39 1 0 0 0 0 35 36 1 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 64 1 0 0 0 0 38 65 1 0 0 0 0 38 66 1 0 0 0 0 39 40 1 0 0 0 0 40 67 1 0 0 0 0 40 68 1 0 0 0 0 40 69 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END