IFLAB-ZINC02710811 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.0020 1.5220 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0080 -0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5190 -0.3690 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -0.5140 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 0.1680 1.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -1.6650 1.8220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -2.5550 1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -3.5420 2.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -2.4060 0.3240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9700 -2.8590 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -0.6320 0.0290 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -3.0920 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -1.9970 2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -1.4420 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -0.8300 4.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -1.6270 5.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -1.0300 6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -0.8960 6.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.3060 7.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 0.1550 8.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 0.0190 8.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -0.5780 7.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 0.4580 9.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 1.3830 10.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 0.8520 11.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 0.7410 9.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.8920 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.8850 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 1.8790 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -2.6310 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 -2.9830 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 -4.1510 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -3.0800 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -1.5620 2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -2.1730 5.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -1.2520 5.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -0.2020 7.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -0.6860 7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 1.4670 11.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 2.3590 10.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.1270 11.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 1.5450 11.8030 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 4 1 0 0 0 0 2 11 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 13 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END