PUBCHEM-ZINC06388587 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 3.2200 2.1930 1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 3.4440 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 3.8520 3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 2.6170 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 1.6870 4.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 1.2900 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 2.9320 4.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 3.9340 5.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 5.3500 5.5510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7490 5.5780 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 6.4200 6.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 7.5320 6.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 6.7690 6.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 5.4700 5.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 2.2410 4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 0.7400 4.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 2.8930 5.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3260 2.6090 5.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1100 1.8410 4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 1.6260 5.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0690 2.1880 6.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3040 2.9810 7.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 3.2000 6.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 3.9480 7.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6930 4.5240 8.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3810 2.0530 6.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1940 1.2190 5.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 3.1280 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 1.6350 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 1.5930 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 2.9030 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 4.3230 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 4.4730 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 4.4750 2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 2.0890 2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 2.1760 5.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.7810 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 0.7040 3.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 0.7200 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 3.5840 6.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 3.9320 6.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 6.0830 7.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 6.7090 5.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 8.2660 7.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 8.0600 5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 6.6260 7.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 7.2640 5.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 3.7520 6.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 1.4330 3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0300 1.0250 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8030 3.4120 7.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9030 5.0710 9.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 5.2420 8.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 3.7520 9.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1960 1.1950 6.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2850 1.6290 4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8140 0.1930 5.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 2.5330 2.7840 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5500 3.0530 3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 58 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 6 58 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END