PUBCHEM-ZINC05578472 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -0.4230 1.0170 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -0.3710 -0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -0.7100 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -2.0840 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -2.5700 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -1.6830 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -0.3060 2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 0.1780 1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -2.2010 4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -2.5080 4.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -3.0710 4.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5230 -3.3360 6.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2650 -3.3150 4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9930 -4.3520 5.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 -4.5370 4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4960 -2.1970 4.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0430 -1.9950 4.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6660 -3.3400 4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3630 -2.1010 5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8830 -2.2450 5.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3400 -2.5410 3.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6310 -3.7610 3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1090 -3.6220 3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 1.5020 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 1.1160 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 1.5100 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.7830 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -3.6440 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 0.4060 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 1.2530 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -1.4650 5.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -3.1060 4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -2.3010 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 -3.7080 3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9700 -4.0530 6.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 -5.3140 5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9550 -5.2160 5.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5140 -4.9190 3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 -2.5880 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 -1.2530 4.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5680 -1.2930 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 -1.5170 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9340 -4.1950 5.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0700 -1.1960 4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0730 -1.9550 6.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3610 -1.3250 5.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2120 -3.0540 5.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1420 -1.6680 3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4240 -2.7040 3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9340 -3.9000 2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9430 -4.6600 3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6470 -4.5410 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8050 -2.8080 2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1490 -3.1980 4.9450 N 0 3 0 0 0 0 0 0 0 0 0 0 8.9990 -2.8440 5.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 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 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 54 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 43 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END