PUBCHEM-ZINC00030796 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 1.3720 1.5960 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 0.0890 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.4950 -0.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3650 -0.1860 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 0.0050 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 0.9030 0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 1.3570 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 0.9210 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 0.0330 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -0.4230 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -2.0340 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -2.6610 -0.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -2.5750 0.8220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -3.9390 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -4.2380 2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -5.5620 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -6.5900 1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -6.3150 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -4.9870 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -8.3030 2.3060 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -8.9850 1.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -8.2020 3.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -8.7310 1.5190 N 0 5 0 0 0 0 0 0 0 0 0 0 -2.7240 -8.7120 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 1.9410 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 2.1350 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 1.8700 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -0.1490 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -0.3820 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 1.2640 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 2.0540 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8510 1.2750 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -0.3070 -2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -1.1210 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -1.9200 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -3.4460 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -5.7860 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -7.1230 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -4.8070 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 34 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 23 -1 M END