PUBCHEM-ZINC05975813 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 2.3820 2.0110 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 0.7150 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -0.4800 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -1.7190 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -1.6820 -0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -2.8620 1.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -4.2310 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -4.8190 -0.7050 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -4.9940 1.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -6.3620 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -6.9020 3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -8.2400 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -9.0620 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -8.5230 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -7.1820 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -10.4630 2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -10.9450 4.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -11.1230 1.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -12.5040 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -13.1440 0.7380 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5860 -12.5870 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -12.9780 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -13.6250 -1.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -15.0910 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -14.6320 0.9140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7440 -15.2100 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -14.8050 1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -16.2490 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -16.8040 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -16.6800 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 1.8730 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 2.6570 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 2.5240 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 0.7820 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -0.5550 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 -2.7020 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -4.5010 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -6.2970 4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 -8.6300 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -9.1240 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -6.8060 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -13.0280 2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -12.5420 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -11.9150 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -13.4240 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -13.0970 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -13.5270 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -15.5260 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -15.6630 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -14.4800 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -14.1680 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -16.8640 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -16.3030 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -17.8570 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 -16.2700 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -17.2570 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -17.0110 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -15.2290 -0.4560 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2380 -14.7030 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 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 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 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 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 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 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 58 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END