PUBCHEM-ZINC03702995 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.4180 1.3450 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.0250 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -0.7490 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -1.5800 2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -2.0940 3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -1.6360 2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -0.6090 1.5910 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -1.9420 3.7500 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3860 -2.6440 4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -0.7190 4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 0.2050 5.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0060 1.3530 5.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 1.5620 5.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 0.6260 4.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 -0.5170 4.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -1.4810 3.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -2.8570 3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8480 2.7080 6.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 2.9420 6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 2.3000 6.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 2.4310 5.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 3.7560 6.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 3.9690 5.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 5.7280 5.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 5.3850 7.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 1.9840 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 1.8460 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 1.2640 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -0.6220 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 0.0850 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -1.8140 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -2.7660 4.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 0.0180 5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 0.7670 4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8220 -1.0540 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5060 -1.5970 4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5350 -3.4770 2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -3.3890 4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4330 3.8800 6.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7850 2.1480 6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6300 3.0600 5.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 2.4260 4.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 1.6080 6.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 3.7550 7.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 4.5760 6.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 3.9600 4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 3.2020 6.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 4.9990 5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 5.7580 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 6.7260 5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 5.2240 8.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 4.6210 8.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 6.3850 8.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 -2.6960 2.8720 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1910 -3.6140 2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 -2.1950 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 5.3150 6.3950 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1320 6.0190 6.2000 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 54 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 57 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 57 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 57 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 54 1 M CHG 1 57 1 M END