PUBCHEM-ZINC04959366 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.0240 2.1630 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 0.6410 -0.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1580 0.3960 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.1680 0.9710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2980 -1.2240 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -0.0890 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 -1.0380 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -0.6480 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 0.5820 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 1.2560 1.5600 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -0.7700 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.3490 4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.3470 4.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 0.5830 3.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 0.2270 2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 0.2070 -1.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -1.0630 -2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -1.8900 -1.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -1.3950 -3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -1.0190 -3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -1.3670 -4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -2.0910 -5.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -2.4720 -5.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -2.1250 -4.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -2.4870 -3.9570 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 2.5140 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 2.6370 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 2.5380 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -1.9720 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 -1.2410 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3750 1.1150 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -0.7450 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -1.7680 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -1.0620 5.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 0.6420 5.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 0.5490 3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 1.5970 4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -0.7680 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 0.9860 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 0.8610 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -0.4800 -2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -1.0810 -5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -2.3620 -6.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -3.0360 -6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 0.1970 2.3580 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3610 1.1330 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 45 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 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 38 1 0 0 0 0 15 39 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END