PUBCHEM-ZINC01032497 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.2310 1.6500 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 0.2050 -0.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.4130 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -1.7390 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -1.9250 -1.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.7650 -1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -3.0060 1.2220 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -3.4340 1.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -2.5150 2.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -4.2910 0.5810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -4.9140 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -5.0390 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -5.6560 -1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -6.1490 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -6.0280 -2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -5.4160 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -5.2980 -1.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -5.6640 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -6.6210 -2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 -6.9400 -3.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 -6.1750 -4.6690 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -4.9980 -3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 -7.3070 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -6.9630 0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 -8.3430 -0.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2830 -8.9900 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 1.9830 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 1.8730 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 2.1680 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 0.0700 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -0.6070 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -4.6110 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -4.6550 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -5.7520 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -6.6300 -3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -6.4140 -3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -4.9560 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 -8.0170 -3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -6.4840 -3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 -4.0270 -3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -4.8960 -4.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 -8.2700 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0080 -9.8030 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 -9.3920 0.7920 H 0 0 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 6 1 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 2 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END