PUBCHEM-ZINC05050385 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -0.6510 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -0.0200 -0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0930 0.5760 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 0.8670 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7620 -0.2910 -2.5540 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7260 -1.1310 -3.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 0.4160 -3.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7920 -1.2150 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9240 -1.2060 -0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5520 -1.1900 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0470 -2.3870 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 -1.9820 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -2.7540 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4770 -3.7180 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 -4.0110 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 -5.3260 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 -6.3510 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 -6.0630 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -4.7500 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -7.1630 -0.0700 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3620 -8.3220 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -6.9110 -0.0580 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9750 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 1.2440 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7770 1.6880 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 -2.2350 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7370 -0.7000 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 -3.2110 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3120 -5.5540 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6600 -7.3790 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -4.5260 -0.0410 H 0 0 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 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END