COMGENEX-ZINC06774589 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -2.0080 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 -2.6960 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 -4.0980 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 -4.7490 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2600 -4.0450 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2710 -2.6800 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -1.9810 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -0.5640 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 0.0230 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1690 0.1840 -0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0970 1.6470 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 2.2280 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4400 3.6910 -0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7860 4.5840 0.3060 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4030 5.9490 0.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3320 4.0230 1.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9650 4.2940 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9830 5.1020 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9080 4.8750 -3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8160 3.8390 -2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7990 3.0310 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8760 3.2620 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 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 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9840 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -4.6580 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -5.8290 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1940 -4.5850 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2090 -2.1450 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0320 -0.2590 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 1.9890 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 1.9800 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0520 1.8860 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0360 1.8950 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6040 4.1360 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2740 5.9120 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9220 5.5060 -3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5380 3.6610 -3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5070 2.2220 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8650 2.6330 0.0300 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END