PUBCHEM-ZINC02870268 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -0.6890 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 0.0240 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 -0.6520 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 -2.0350 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 -2.7480 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -2.0820 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6570 -2.8920 -0.0860 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3950 -4.1760 -0.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6100 -1.9920 -0.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1000 -3.1390 1.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7120 -4.3330 2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5640 -3.9790 3.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0120 -2.8570 3.9440 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9200 -2.1760 2.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4400 -1.1970 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2980 -2.0780 1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0060 -0.8940 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2700 -0.8050 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8250 -1.9000 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1170 -3.0850 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8550 -3.1750 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1780 -1.8040 -0.0610 N 0 3 0 0 0 0 0 0 0 0 0 0 14.8020 -0.7600 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6680 -2.7690 -0.6200 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 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 1.2190 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9830 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 1.1040 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0270 -0.1000 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -3.8280 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -2.6400 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7610 -4.7060 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 -5.1010 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6280 -3.4560 3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6590 -4.8650 4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5720 -0.0390 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8230 0.1200 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5510 -3.9400 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3040 -4.1020 0.9480 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END