PUBCHEM-ZINC06403259 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0270 -2.0640 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.8930 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -4.5740 3.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -6.2270 3.2900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -6.5620 2.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -6.6530 3.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -6.8120 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -6.9970 4.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -7.4560 5.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -7.7290 6.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -7.5440 7.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -7.0900 5.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 -8.2270 8.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -1.9180 2.5290 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3470 -1.2180 3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -0.7570 3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -1.0410 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0130 -1.7800 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -2.2100 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -4.3970 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -6.7840 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -7.6000 5.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -7.7560 7.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -6.9480 5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -9.3160 8.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -7.8960 9.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -7.8300 8.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -1.0010 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 -0.1840 4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 -0.6940 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -2.0190 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -2.7900 0.6870 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 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 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M CHG 1 20 1 M END