PUBCHEM-ZINC05554558 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 71 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9800 -2.0870 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -2.0970 -2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -2.8590 -2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -4.2760 -3.2810 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0020 -4.9560 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -4.5380 -3.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -4.0460 -2.5970 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6650 -4.4780 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -4.4510 -2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -3.6060 -3.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -5.7500 -3.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -6.0660 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -7.5840 -3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -4.5120 -4.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -5.4310 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 -5.6670 -5.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 -5.5430 -5.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 -5.7820 -6.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3420 -5.6580 -5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2740 -5.8980 -7.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7280 -5.7740 -6.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6600 -6.0140 -7.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0920 -5.8910 -7.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3430 -5.6390 -6.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0900 -6.0630 -8.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4450 -5.9310 -7.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4390 -6.1590 -8.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -1.0940 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -2.4500 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -3.9980 -4.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -5.6070 -3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -5.6740 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -5.6140 -4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -7.8220 -3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -7.9760 -4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -8.0360 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -3.9230 -5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 -6.0200 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3300 -6.6660 -5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -4.9260 -6.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1270 -4.5430 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1580 -6.2830 -4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7160 -6.7820 -6.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6860 -5.0420 -7.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5130 -4.6590 -5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5440 -6.3990 -5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1020 -6.8980 -7.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0720 -5.1580 -7.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8990 -4.7740 -6.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9300 -6.5140 -5.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4880 -7.0130 -8.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4580 -5.2730 -8.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5850 -4.9300 -7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6150 -6.6700 -6.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3000 -7.1600 -9.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2690 -5.4200 -9.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4560 -6.0600 -8.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 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 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 2 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 27 28 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 M END