PUBCHEM-ZINC06545045 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -0.6840 0.8270 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -0.5540 0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -0.8680 -0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -2.2320 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -2.6880 -2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -1.7970 -3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -0.4290 -2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 0.0350 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -2.3110 -4.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 -1.5320 -5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -2.3550 -6.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -1.6090 -7.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1550 -0.4330 -5.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -1.1750 -4.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -0.6140 -8.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4190 -0.4950 -8.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2490 -1.6200 -8.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6120 -1.5130 -7.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1670 -0.2810 -7.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 0.8570 -7.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9770 0.7430 -7.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9550 2.0300 -7.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1280 3.1590 -6.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4900 -0.0870 -7.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3760 -1.1890 -7.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 1.3200 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 1.3290 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 0.9030 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -2.9520 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -3.7610 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 0.3150 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 1.1070 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -3.3230 -4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -0.6190 -5.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -3.3220 -6.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -2.5820 -6.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -2.2390 -8.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -0.6730 -7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 0.5280 -6.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1930 -0.2690 -5.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -0.5510 -3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 -2.0850 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4870 0.3630 -8.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 -1.2340 -9.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8510 -2.5930 -8.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2140 -2.4140 -7.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 1.6140 -7.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 3.9710 -6.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6440 3.5010 -7.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3920 2.9490 -6.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1230 -1.9930 -6.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3870 -1.5500 -8.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3840 -0.8420 -7.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 -1.2630 -7.2140 N 0 3 0 0 0 0 0 0 0 0 0 0 5.6420 -2.1440 -7.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 54 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END