PUBCHEM-ZINC05963304 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 79 0 0 1 0 0 0 0 0999 V2000 0.0720 3.3790 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 1.9580 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 2.0050 -1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.9710 1.4790 S 0 3 0 0 0 0 0 0 0 0 0 0 0.9510 -0.7260 0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 1.0300 2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 0.2310 4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 0.2810 5.2970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4080 1.3200 5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -0.4340 4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -0.4100 6.4730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5890 -1.4740 6.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 0.2480 6.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 0.5400 8.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -0.3980 8.8180 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1480 -1.4380 8.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -0.1650 7.7670 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4710 -1.1200 7.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -1.1900 9.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -0.1260 10.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5620 0.8660 10.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -0.1870 10.2230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6640 -1.0330 10.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 1.1020 10.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 1.1820 12.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 0.5760 12.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -0.2500 11.7870 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5900 -1.6930 12.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -1.7840 13.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -0.7620 14.6250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8870 -0.9170 15.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 0.6640 14.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -0.9380 14.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 0.2870 11.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 1.2830 7.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 3.8330 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 3.9720 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 3.3450 1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 1.5040 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 2.4590 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 0.9930 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 2.5980 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -0.8130 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -1.4180 1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.9670 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 2.0660 3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 0.6000 2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.8050 3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 0.6610 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -1.5000 4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -0.2830 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -0.0280 4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -0.4360 6.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 1.1780 6.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 0.2510 8.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 1.5800 8.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -0.8050 7.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -2.1240 7.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -1.0870 9.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -2.1840 9.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 1.0700 10.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 1.9650 10.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 1.7760 12.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -2.0600 12.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -2.3170 11.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -2.7870 14.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -1.6260 13.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 1.0850 14.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 1.2930 14.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 -0.3170 15.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -0.3010 11.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 0.2130 12.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 1.3300 11.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 1.3920 6.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 1.5500 8.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 1.9420 7.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 50 1 0 0 0 0 10 51 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 53 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 55 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 26 2 0 0 0 0 25 63 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 27 28 1 0 0 0 0 27 34 1 0 0 0 0 28 29 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 33 70 1 0 0 0 0 34 71 1 0 0 0 0 34 72 1 0 0 0 0 34 73 1 0 0 0 0 35 74 1 0 0 0 0 35 75 1 0 0 0 0 35 76 1 0 0 0 0 M CHG 1 4 1 M END