PUBCHEM-ZINC03873145 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -0.3090 0.5030 -2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.8370 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -1.4520 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -0.7300 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 0.6190 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 1.2330 -1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -1.3840 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -1.1090 -2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8150 -1.5860 -1.5940 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0070 -1.0630 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 -1.1730 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 -2.1020 -3.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7280 -3.5400 -0.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6970 -3.0580 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2010 -3.2190 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -3.8900 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 -3.2990 2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -4.0440 2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9040 -5.0820 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 -5.8160 -0.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1300 -5.6020 -0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3300 -4.8720 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1270 -5.8720 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8190 -7.1990 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3550 -7.0610 -0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6750 -7.4440 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2040 -7.8950 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5490 -7.3300 -2.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 0.9840 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -1.4010 -3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -2.4940 -2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 1.1990 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 2.2810 -1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -1.0180 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -2.4630 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -1.5850 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 -0.0320 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9410 -3.5440 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 -2.1350 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 -3.7880 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 -4.9630 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -3.3580 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -2.2360 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -4.0550 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 -5.0680 3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8540 -4.5970 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1060 -3.9680 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1960 -5.6430 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7580 -5.8920 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4920 -7.3370 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9670 -8.0480 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 0.0370 -2.5800 O 0 5 0 0 0 0 0 0 0 0 0 0 5.8060 -3.0670 -1.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 -3.4190 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -3.3500 4.1160 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3880 -3.8390 4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -2.3930 3.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -3.2790 4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8130 -9.0880 -1.1170 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 53 1 0 0 0 0 11 12 2 0 0 0 0 11 52 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 13 53 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 55 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 59 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 M CHG 1 52 -1 M CHG 1 55 1 M CHG 1 59 -1 M END