PUBCHEM-ZINC06134924 MOE2007 3D CORINA 3.40 0006 02.08.2006 88 89 0 0 1 0 0 0 0 0999 V2000 0.6770 -2.2610 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -1.6050 -2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -1.8070 -2.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -0.1070 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.0970 -1.5070 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5060 -0.4750 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -0.3720 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 0.4340 -3.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -1.6890 -2.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 1.5190 -1.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 1.8970 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 1.0680 0.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 3.3500 -0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4990 3.9690 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 3.7040 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 5.1920 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 3.4030 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 3.5920 0.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 4.8250 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 5.7350 -0.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 5.0740 0.8290 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1890 4.5230 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 4.6040 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4110 4.7380 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9990 3.6860 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2880 3.8070 1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9930 4.9850 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4010 6.0390 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1140 5.9110 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2620 5.1070 1.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9270 6.3480 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3120 6.2980 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3740 5.8470 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6440 5.8020 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8530 6.2070 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7920 6.6600 3.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5220 6.7090 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 6.5060 1.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 7.3880 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7350 6.9940 -1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 8.7040 0.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 9.5950 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 9.4510 -1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 11.0400 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 9.2330 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -2.2070 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -1.7380 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -3.3050 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -2.0600 -2.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -1.3520 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -1.3390 -3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -2.8740 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 0.3760 -2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 0.3300 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -2.3380 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 -1.9860 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 2.1890 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 3.1120 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 5.7850 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 5.4440 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 5.4070 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.3280 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 3.7530 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 3.9120 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 2.8650 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8060 3.5600 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8900 5.2140 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4490 2.7690 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7460 2.9850 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9480 6.9580 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6540 6.7300 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9970 6.5210 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3630 7.1580 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2100 5.5300 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4730 5.4480 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8450 6.1710 3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9550 6.9760 4.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6930 7.0660 3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4460 6.8210 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 9.7090 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 10.1190 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 8.4210 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 11.1430 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1100 11.7090 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 11.2980 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8380 8.2030 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8620 9.9010 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0260 9.3350 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 49 1 0 0 0 0 3 50 1 0 0 0 0 3 51 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 53 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 55 1 0 0 0 0 9 56 1 0 0 0 0 10 11 1 0 0 0 0 10 57 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 58 1 0 0 0 0 16 59 1 0 0 0 0 16 60 1 0 0 0 0 16 61 1 0 0 0 0 17 62 1 0 0 0 0 17 63 1 0 0 0 0 17 64 1 0 0 0 0 18 19 1 0 0 0 0 18 65 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 38 1 0 0 0 0 23 24 1 0 0 0 0 23 66 1 0 0 0 0 23 67 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 68 1 0 0 0 0 26 27 1 0 0 0 0 26 69 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 70 1 0 0 0 0 29 71 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 72 1 0 0 0 0 31 73 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 74 1 0 0 0 0 34 35 1 0 0 0 0 34 75 1 0 0 0 0 35 36 2 0 0 0 0 35 76 1 0 0 0 0 36 37 1 0 0 0 0 36 77 1 0 0 0 0 37 78 1 0 0 0 0 38 39 1 0 0 0 0 38 79 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 43 80 1 0 0 0 0 43 81 1 0 0 0 0 43 82 1 0 0 0 0 44 83 1 0 0 0 0 44 84 1 0 0 0 0 44 85 1 0 0 0 0 45 86 1 0 0 0 0 45 87 1 0 0 0 0 45 88 1 0 0 0 0 M END