PUBCHEM-ZINC00448821 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.6870 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 0.4670 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -0.3360 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 0.0650 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 1.3010 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 2.1050 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -0.7840 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 -1.2890 -1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -2.1030 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7720 -2.4340 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -1.9350 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -1.1210 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9080 -3.2630 -0.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 -3.7570 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2630 -3.5530 2.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8550 -4.5620 0.6430 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4900 -3.8580 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6310 -4.9600 1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 -6.1000 2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6500 -7.3010 1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8870 -6.9070 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 -5.8210 -0.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6420 -6.2190 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0440 -5.6150 -1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8480 -4.4000 -1.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 2.3130 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 0.1360 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.2920 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 1.6560 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 3.0570 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 -1.0490 -2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7540 -2.4820 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 -2.1650 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -0.7630 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2940 -3.5680 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6420 -5.2770 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7580 -4.0950 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6250 -6.4130 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0420 -5.7470 3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5880 -7.7960 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0680 -8.0340 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 -7.8050 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8830 -6.5530 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8300 -6.6570 -2.3120 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 44 -1 M END