IFLAB-ZINC02702296 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 0.2270 1.4600 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.0450 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.7440 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -2.1220 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.8150 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -2.1090 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -0.7240 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -0.0110 -2.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -0.6720 -3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.9510 -3.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.4600 -4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -3.6430 -5.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -1.4930 -6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -1.7200 -7.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -3.0430 -7.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -3.4140 -9.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -4.8150 -9.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -5.2360 -7.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -4.1690 -7.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 0.0420 -5.1950 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -4.2900 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -4.8910 -1.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 1.7700 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 1.8580 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 1.8410 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.2110 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -2.6650 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -2.6390 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 0.9500 -2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -0.8890 -8.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -2.7550 -10.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -5.4410 -10.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -6.2660 -7.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -4.9700 1.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -5.9340 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 34 35 1 0 0 0 0 M END