PUBCHEM-ZINC05523753 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 59 0 0 1 0 0 0 0 0999 V2000 0.1870 2.4120 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 0.9300 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 0.1280 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -1.3620 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -2.1640 2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -3.6520 2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -4.1260 1.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -4.5140 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -6.0010 3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -6.8620 4.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7450 -6.5250 4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -8.3810 3.8010 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6600 -8.6620 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -9.1860 5.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9850 -10.2590 4.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -8.7800 6.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -7.2770 6.4690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7480 -6.9770 7.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -6.5850 5.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.9430 6.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -8.9740 5.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -8.1650 5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -8.7150 2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -10.1750 2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -10.6750 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -12.1330 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -12.6910 0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -14.1800 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -14.7900 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 -14.0800 -0.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.8210 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 2.9660 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 2.5870 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 0.5610 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 0.7930 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 0.5040 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 0.2710 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -1.7390 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -1.5080 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -1.8070 2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -2.0380 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -4.1600 3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -4.3550 4.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -6.3420 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -6.1150 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -9.0610 6.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -9.3010 7.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -6.0600 7.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -8.1400 1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 -8.4050 2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -10.8430 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -10.0090 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 -12.2460 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -12.7120 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -12.5350 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -12.1390 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -14.3450 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -14.7200 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -15.9550 0.7910 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 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 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 M CHG 1 59 -1 M END