IFLAB-ZINC04034422 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4200 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.6490 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 0.2930 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -0.4880 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 -1.4170 0.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0310 -2.3590 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -1.5780 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3650 -2.0900 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 -2.9660 1.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9420 -3.5390 1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 -4.5140 2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8170 -4.9870 2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4930 -4.5060 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9000 -3.5530 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6300 -3.0670 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6190 -1.8770 -0.2330 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7050 -5.1310 0.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5960 -6.2920 1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6100 -5.9130 2.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 1.9760 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 0.9610 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 0.8760 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0810 -1.0510 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 0.2060 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -2.9430 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -3.0280 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -1.0150 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -2.2730 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0480 -4.8920 3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4230 -3.1810 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2530 -7.1530 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5500 -6.5070 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 24 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 39 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END