PUBCHEM-ZINC05700641 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 61 0 0 0 0 0 0 0 0999 V2000 0.3570 0.8620 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 2.9010 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 3.3830 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 3.6670 3.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 4.0850 4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 4.2240 4.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 3.9370 3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 3.5160 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 4.6420 5.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 4.8290 5.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4080 5.3020 7.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9180 5.5260 7.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3700 5.9910 8.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8820 6.2110 8.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3430 6.6660 9.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7600 6.8430 9.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3790 7.2600 11.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7590 7.4390 10.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5190 7.8630 11.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9030 8.1200 13.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5190 7.9310 13.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7610 7.5070 12.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7200 8.5430 14.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0570 7.7040 16.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -0.2230 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 1.2830 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 1.1280 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 3.1760 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 3.3310 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 3.5750 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 4.3090 5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 4.0300 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 3.3010 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 5.5890 4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4450 3.8820 5.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1100 4.5620 7.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 6.2260 7.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2020 6.2750 6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4360 4.5950 6.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0840 5.2420 9.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8550 6.9230 8.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1810 6.9580 7.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4090 5.2880 8.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0850 5.8990 10.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8540 7.6140 10.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2470 7.2480 9.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5910 7.9950 11.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0070 8.1180 14.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6910 7.3810 12.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1220 9.1460 15.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5870 9.1360 14.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3660 6.7640 16.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9280 8.2700 16.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4440 8.2890 17.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 1.4140 1.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3760 0.9910 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 1.1330 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2320 7.3640 15.1590 N 0 3 0 0 0 0 0 0 0 0 0 0 -14.7780 6.7720 14.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4310 6.7870 15.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 55 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 58 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 24 58 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 58 59 1 0 0 0 0 58 60 1 0 0 0 0 M CHG 1 55 1 M CHG 1 58 1 M END