CHEMSTAR-ZINC04045726 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 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 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.7010 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -2.1450 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.7130 -2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -1.1610 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -1.3940 -4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -1.1820 -4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -0.7360 -3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5060 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -1.4370 -5.9510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5840 -1.7800 -6.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -2.5060 -5.6860 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5320 -1.9680 -5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5190 -2.9660 -4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7740 -3.9080 -3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -4.6300 -4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -3.5990 -4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -3.6460 -4.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -0.7140 -4.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 0.2500 -5.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 -0.1380 -6.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9060 0.9520 -6.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 0.7180 -6.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 2.1820 -6.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 3.1820 -7.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 4.5100 -7.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 4.9980 -6.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 6.1780 -6.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 6.7110 -5.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 7.9100 -6.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 8.5800 -7.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 8.0520 -8.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 6.8550 -7.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 1.4920 -4.8710 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 2.5450 -0.5230 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -0.0180 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -2.3230 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -2.8280 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 -2.3120 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -1.3260 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -1.7420 -5.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -0.5710 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -0.1620 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 -2.4350 -3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 -3.5430 -5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3400 -3.3310 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 -4.6420 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 -5.2780 -3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -5.2250 -5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 -0.2950 -7.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 3.3130 -6.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 2.8540 -7.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 5.2360 -7.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 4.3590 -8.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 6.1880 -4.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 8.3250 -5.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 9.5180 -7.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 8.5760 -9.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 6.4450 -8.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 1.7510 -4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 -2.9400 -6.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 2.2430 -5.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 48 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 68 1 0 0 0 0 15 16 1 0 0 0 0 15 21 2 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 36 2 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 32 63 1 0 0 0 0 33 34 2 0 0 0 0 33 64 1 0 0 0 0 34 35 1 0 0 0 0 34 65 1 0 0 0 0 35 66 1 0 0 0 0 36 67 1 0 0 0 0 36 69 1 0 0 0 0 M END