PUBCHEM-ZINC06409711 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.1050 1.2260 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.2760 -0.1780 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9470 -0.7140 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -0.5940 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -0.0530 1.2280 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -1.0380 -0.2010 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1210 -2.0480 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -1.2080 -1.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -0.9010 -1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -1.1670 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -1.1320 -2.5440 O 0 5 0 0 0 0 0 0 0 0 0 0 4.3300 -0.4870 -0.7420 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3980 0.6030 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -1.1740 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6080 -2.4120 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 -0.7420 -2.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 -1.1750 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 -0.4130 -2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5090 0.1780 -2.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 -0.8690 -4.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 -0.7160 -5.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5060 -0.9880 -4.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 -1.5550 -6.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7390 -0.7830 -7.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 0.6250 -7.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 0.9940 -5.8840 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 1.7240 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 1.4060 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.7110 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -0.1030 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.6710 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -1.9320 -4.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -0.3350 -4.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5850 -1.7060 -6.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 -2.5510 -6.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 -1.2500 -8.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -0.7670 -7.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1820 0.6770 -8.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 1.3500 -7.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.3880 -3.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 -0.4220 0.9350 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 11 -1 M CHG 1 41 -1 M END