PUBCHEM-ZINC04210945 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 79 0 0 0 0 0 0 0 0999 V2000 0.1110 1.2690 -0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -0.2290 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -0.4510 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -1.9490 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -2.1610 2.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -2.0770 3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -3.3950 3.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -4.3150 3.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -3.5530 5.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -2.4420 6.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -1.6050 5.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -0.4620 6.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -0.4430 7.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 0.7630 8.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 1.0120 9.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 1.5700 7.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 0.8350 6.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 1.4070 5.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 2.6770 5.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 3.4040 7.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 2.8620 7.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -4.8340 5.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -5.7180 6.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -5.6780 7.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -6.4860 8.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -7.3400 7.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -7.3770 6.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -6.5700 5.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -8.1580 8.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -8.0290 9.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -9.1460 7.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -2.4340 2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -2.4100 1.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 -2.7640 3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -3.6720 4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -3.9760 5.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -3.3820 5.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 -2.4800 4.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 -2.1730 3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 -3.7680 7.3290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 1.6630 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 1.4270 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 1.7840 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -0.6220 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -0.7440 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -0.0570 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 0.0640 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -2.3420 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -2.4640 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -1.8470 4.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -1.2910 3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -2.8370 7.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -1.8180 6.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -1.2100 4.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -2.2290 5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -1.2590 8.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 0.8470 4.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 3.1190 5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 4.4070 7.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 3.4350 8.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -4.6620 6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -5.3210 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -5.0140 8.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -6.4550 9.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -8.0390 5.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -6.6020 4.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -8.6960 10.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -8.2940 10.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -7.0000 10.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -9.0340 6.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -8.9880 7.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -10.1490 7.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -4.1350 4.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -4.6780 6.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 -2.0190 5.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 -1.4740 3.1070 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 2 44 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 48 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 50 1 0 0 0 0 6 51 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 52 1 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 54 1 0 0 0 0 11 55 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 56 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 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 19 20 2 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 61 1 0 0 0 0 22 62 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 63 1 0 0 0 0 25 26 1 0 0 0 0 25 64 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 65 1 0 0 0 0 28 66 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 31 70 1 0 0 0 0 31 71 1 0 0 0 0 31 72 1 0 0 0 0 32 33 2 0 0 0 0 32 34 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 73 1 0 0 0 0 36 37 1 0 0 0 0 36 74 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 75 1 0 0 0 0 39 76 1 0 0 0 0 M END