PUBCHEM-ZINC05819717 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 48 0 0 1 0 0 0 0 0999 V2000 -1.4880 2.1130 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 0.8480 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -0.1520 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -1.4010 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -2.3140 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -3.4780 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 -4.3230 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -2.1490 3.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -3.0580 2.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -1.6000 4.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -2.3680 5.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1050 -3.2650 4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -2.7570 6.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -4.0100 6.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -5.0760 6.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -1.4830 5.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -1.2370 4.8760 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5700 -0.4000 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 -0.4610 5.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -2.5500 4.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 1.8850 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 2.8130 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 2.6130 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7310 1.1140 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 0.4050 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -0.4530 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 0.3590 2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -1.0950 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 -1.7320 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -2.7100 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -4.1220 2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -3.0910 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -3.7250 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -4.7500 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -5.1480 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -3.0040 7.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -1.9590 6.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -0.4910 6.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -1.9500 6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 0.4740 4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 -0.0860 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -1.0070 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 -1.0680 6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -0.2710 4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 0.4830 5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -3.0490 3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 -2.3220 3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -3.1720 5.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -3.8170 5.7900 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 49 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 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 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 M CHG 1 17 1 M CHG 1 49 -1 M END