PUBCHEM-ZINC05674754 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 0.6060 1.6280 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 0.3790 0.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -0.3400 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -0.0880 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 0.8100 1.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -1.7710 -0.0320 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5210 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -3.9900 -0.2210 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0980 -4.3750 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -4.3790 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -4.2110 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 -3.1390 -3.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 -3.3770 -4.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -2.7540 -5.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 -4.5900 -4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -5.1370 -3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -6.3920 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -7.0530 -4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -6.4820 -5.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -5.2390 -5.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -4.6530 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -3.9000 2.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 1.4480 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 2.3680 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 2.0250 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -1.0340 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -0.8880 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 0.3710 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -2.3850 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -5.4260 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1020 -3.7920 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 -2.2260 -2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 -6.8400 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -8.0210 -4.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -7.0100 -6.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -4.7970 -6.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -5.8500 1.2270 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 M CHG 1 37 -1 M END