PUBCHEM-ZINC06511914 MOE2007 3D CORINA 3.40 0006 02.08.2006 88 89 0 0 1 0 0 0 0 0999 V2000 1.5970 0.6810 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 1.1170 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 2.8140 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 4.1240 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 0.9080 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 1.6190 1.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5240 2.7020 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 1.3250 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 1.8750 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 1.8090 5.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1580 2.3180 5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 0.3580 5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 0.4070 8.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -0.6080 8.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 0.9050 7.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 0.4540 6.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 2.5260 5.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 1.9670 5.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 3.9130 6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 4.3910 7.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 5.6780 7.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 6.5050 7.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 6.0360 6.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 4.7460 5.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 7.7310 7.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 8.6120 7.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 9.8880 8.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 1.0890 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1510 -0.0800 0.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 1.9640 -0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 1.3880 -1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 2.1860 -2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 3.5550 -2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 4.1210 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6340 3.3260 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 4.2190 -3.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 5.6180 -3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 6.1370 -4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 0.2070 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 1.5380 2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -0.0450 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 1.7960 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 0.2700 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 3.0060 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 2.3060 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 4.6050 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 3.9830 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 4.8120 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 0.0870 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 0.4950 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 1.7610 2.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 0.2430 2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 1.3310 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 2.9200 3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 -0.2080 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -0.1780 5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 0.2630 9.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 1.4380 8.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -1.6310 8.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -0.4430 7.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -0.5320 9.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 1.9840 7.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 0.6370 8.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 0.7820 5.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4100 -0.6360 6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 0.8830 6.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 3.7720 7.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 6.0390 8.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 6.6500 6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 4.4380 5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 8.8560 6.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 8.1550 7.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 10.6010 8.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 9.6700 9.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 10.3560 8.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 0.3240 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7110 1.7370 -3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 5.1770 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 3.7960 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0840 5.8000 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 6.1420 -3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9260 5.6160 -5.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 7.2110 -4.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3140 5.9550 -5.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 1.8680 0.4300 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1420 2.4440 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 0.1970 6.9680 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1430 -0.8030 7.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 2 85 1 0 0 0 0 3 4 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 3 85 1 0 0 0 0 4 46 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 49 1 0 0 0 0 5 50 1 0 0 0 0 5 85 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 28 1 0 0 0 0 8 9 1 0 0 0 0 8 51 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 53 1 0 0 0 0 9 54 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 55 1 0 0 0 0 12 56 1 0 0 0 0 12 87 1 0 0 0 0 13 14 1 0 0 0 0 13 57 1 0 0 0 0 13 58 1 0 0 0 0 13 87 1 0 0 0 0 14 59 1 0 0 0 0 14 60 1 0 0 0 0 14 61 1 0 0 0 0 15 16 1 0 0 0 0 15 62 1 0 0 0 0 15 63 1 0 0 0 0 15 87 1 0 0 0 0 16 64 1 0 0 0 0 16 65 1 0 0 0 0 16 66 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 67 1 0 0 0 0 21 22 1 0 0 0 0 21 68 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 69 1 0 0 0 0 24 70 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 71 1 0 0 0 0 26 72 1 0 0 0 0 27 73 1 0 0 0 0 27 74 1 0 0 0 0 27 75 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 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 76 1 0 0 0 0 32 33 1 0 0 0 0 32 77 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 78 1 0 0 0 0 35 79 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 80 1 0 0 0 0 37 81 1 0 0 0 0 38 82 1 0 0 0 0 38 83 1 0 0 0 0 38 84 1 0 0 0 0 85 86 1 0 0 0 0 87 88 1 0 0 0 0 M CHG 1 85 1 M CHG 1 87 1 M END