PUBCHEM-ZINC04536193 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 0.3460 0.4390 1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -0.9910 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -1.7910 1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -1.3820 0.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -2.7730 0.2780 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4240 -3.1620 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -3.6030 1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -3.0860 2.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -2.8380 -0.7060 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6970 -3.8780 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -2.0640 -1.9760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2420 -2.4980 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 -2.1440 -2.9680 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1810 -1.6820 -2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -1.4060 -4.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -1.3800 -5.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -3.5130 -3.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -0.6960 -1.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -2.2570 -0.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 -3.0700 -0.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9550 -3.4100 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 -2.2600 0.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1430 -1.3680 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2950 -3.1400 0.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5210 -3.2400 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0340 -4.5000 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -4.9370 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 -4.2000 0.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -6.2870 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6290 -6.9720 1.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4050 -2.5370 0.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -1.8840 1.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5010 -0.5170 1.9360 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 -0.2210 3.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1960 0.3240 0.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 0.5650 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 1.0990 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 0.6890 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -0.7420 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -4.6600 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -0.3850 -4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -1.9210 -4.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -0.9270 -5.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -3.9880 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -0.5570 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -5.1420 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2270 -3.0400 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -6.7620 1.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0160 -0.6660 1.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4890 0.1530 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -7.6530 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 32 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 31 47 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 2 0 0 0 0 33 49 1 0 0 0 0 48 51 1 0 0 0 0 49 50 1 0 0 0 0 M END