PUBCHEM-ZINC00728074 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.1040 0.4370 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.8580 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -1.5340 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -2.2750 -1.3530 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3400 -3.5800 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -4.1330 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -2.8740 -3.6990 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -1.6940 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -0.3510 -2.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 0.1890 -3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -0.2680 -4.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 0.2580 -6.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 1.2460 -6.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 1.7110 -4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 1.1710 -3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 2.7620 -5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5770 3.2270 -6.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 1.7620 -7.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -4.3670 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -5.7150 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -6.4420 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -5.8360 1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -4.4980 1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -3.7630 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 0.9220 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 1.0210 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -1.4410 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -2.2230 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -0.7820 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -5.1710 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 0.2160 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -1.0370 -4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -0.1020 -7.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 1.5210 -2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 1.2920 -7.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -6.1890 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -7.4860 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -6.4080 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -4.0300 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -2.7200 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 3.2070 -3.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4560 3.8970 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 8 2 0 0 0 0 5 6 2 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 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 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 4 1 M END