PUBCHEM-ZINC06129887 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -4.8160 -2.2460 -5.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -2.6070 -4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 -3.1920 -3.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3190 -3.4630 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 -3.4040 -2.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -2.9850 -3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -2.4440 -4.6460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -3.0060 -2.8030 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -4.4550 -1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -4.5010 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -3.3970 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -3.4040 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -2.0820 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.3220 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -2.1030 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 0.0900 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 1.0270 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.3890 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 2.8350 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 1.9250 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 0.5560 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 -0.3600 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -1.1120 0.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -0.2170 -1.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -1.1170 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -5.8220 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -6.7080 -1.8390 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.5740 -1.5260 -5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2430 -1.7920 -6.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3220 -3.1320 -6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -5.4700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 -4.2760 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -1.7340 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 0.6950 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 3.1010 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 3.8940 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 2.2850 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 -0.8950 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -2.1560 -2.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -0.9760 -3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -5.9140 -3.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 2 0 0 0 0 M CHG 1 27 -1 M END