PUBCHEM-ZINC05185702 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 0.0670 1.7080 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 0.1970 -0.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8680 -0.0300 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -0.4670 -0.5270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1670 -1.1380 -1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 0.6120 -0.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1880 0.9620 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 1.9890 0.2730 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 0.1560 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 1.1880 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2220 0.6490 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 1.6690 -1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 1.1440 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 0.0230 -0.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6170 2.0600 -1.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0340 1.7520 -1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8730 2.9280 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3670 2.6040 -2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1980 3.7920 -2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6930 3.4840 -2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5920 4.6300 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0100 5.6910 -3.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -1.3150 0.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -1.3050 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -1.9490 2.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -0.4450 1.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 2.2210 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 2.1220 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 -0.0810 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -0.7740 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 1.4430 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 2.1120 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 0.3840 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3200 -0.2740 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0680 1.9310 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 2.5870 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3240 2.9700 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3000 1.4820 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1970 0.8700 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5720 3.1970 -3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6720 3.8060 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6670 2.3400 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5660 1.7300 -2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8920 4.0570 -3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9920 4.6650 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9980 3.2240 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8980 2.6130 -3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -1.8810 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -0.3090 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8290 4.3640 -3.0990 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 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 4 1 0 0 0 0 2 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 49 1 0 0 0 0 M CHG 1 50 -1 M END