PUBCHEM-ZINC06363128 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 42 0 0 1 0 0 0 0 0999 V2000 -0.3420 1.2470 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.0140 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -0.7000 -0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3060 -1.1840 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -1.7880 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -1.5180 1.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 0.2520 -0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 1.0560 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 1.0850 -2.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 1.9680 -0.7430 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7200 1.3860 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 3.1540 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 4.0770 0.9660 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7310 3.8790 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 2.3760 -2.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8270 2.8590 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6300 3.0020 -1.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 3.2300 -3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 3.8290 -3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8070 4.3170 -5.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2320 4.8200 -5.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9770 4.0610 -5.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4920 5.3130 -6.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9640 6.5040 -6.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 1.9430 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 1.6020 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.6540 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 0.2260 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 3.8610 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 2.8240 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 2.2690 -2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 2.3290 -4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 3.9510 -3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6490 4.6610 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2870 3.0760 -3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6180 3.4920 -5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 5.1070 -5.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -2.7980 0.8280 O 0 5 0 0 0 0 0 0 0 0 0 0 9.2230 4.5520 -7.7960 O 0 5 0 0 0 0 0 0 0 0 0 0 9.5110 6.0120 -4.5010 N 0 3 0 0 0 0 0 0 0 0 0 0 10.2490 5.8650 -3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6820 6.4660 -4.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8910 6.6790 -5.2490 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 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 31 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 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 M CHG 1 38 -1 M CHG 1 39 -1 M CHG 1 40 1 M END