PUBCHEM-ZINC06416763 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.4640 1.5290 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 0.1320 0.2720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0230 0.2490 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -0.5700 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -2.3400 0.7120 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.6170 1.3320 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8220 -2.3500 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -1.7860 0.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 -0.6070 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 0.0670 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 0.8590 -1.4130 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2500 -4.1070 1.1660 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7940 -4.5620 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -4.8250 2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -4.5360 3.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 -4.1960 0.9470 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -3.2940 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -5.3550 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -6.4540 0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 -5.1070 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -6.3830 0.2810 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1670 -7.0990 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0740 -6.0930 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9370 -7.3110 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8110 -7.5780 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 -7.2310 1.8590 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 2.0550 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 2.1560 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 1.4670 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -0.1490 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.4200 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2610 -4.5090 1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 -4.4860 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5220 -5.1970 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0020 -5.9120 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9810 -7.1380 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5830 -8.1750 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4450 -6.8980 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0750 -8.6070 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 -0.2160 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -5.6030 2.2790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 11 -1 M CHG 1 41 -1 M END