PUBCHEM-ZINC00424572 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0450 1.3840 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.0030 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -0.6360 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 0.1380 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -0.4760 -0.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 0.1460 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 -1.8270 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 -2.3600 -0.4330 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -2.6250 -0.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -2.0910 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -2.7710 0.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -4.0980 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 -4.6480 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -6.1780 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -8.1510 2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -8.5350 4.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 -8.3690 5.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -6.9090 5.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -6.1680 4.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -6.5850 3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 1.4840 -0.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.0770 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 1.9120 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -0.5770 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -4.5010 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 -4.4480 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 -4.2890 1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -4.2500 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -6.5920 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 -6.5450 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -8.2320 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 -8.8070 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -9.5900 4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 -7.9700 4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -8.8780 5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -8.8750 6.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -6.8620 6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 -6.3670 5.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -6.2860 5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -5.0940 4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -7.5380 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -5.8350 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1610 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -6.7190 2.7600 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7100 -6.1410 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 21 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END