IFLAB-ZINC04249104 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 0 0 0 0 0 0999 V2000 -0.0240 1.4340 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 0.0540 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6450 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 0.0510 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4360 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.1250 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 2.1390 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 3.3620 -1.1150 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 4.2330 -0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1500 3.7940 -0.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 2.6530 -2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 2.6790 -3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 2.1190 -4.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 1.5280 -5.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 1.5060 -4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 2.0740 -3.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 0.8970 -5.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 -0.0380 -6.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 0.7160 -7.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 0.9210 -6.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -2.1270 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.9240 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -4.2400 0.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -4.1790 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -2.9190 0.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -5.8100 0.4740 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -6.6840 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -5.5670 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9730 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -0.4830 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -0.4860 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 3.2040 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 1.9100 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 3.1370 -2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 2.1400 -5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 2.0580 -2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5830 1.6920 -5.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4560 0.3330 -4.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4900 -0.3440 -6.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -0.9170 -5.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 1.6840 -7.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 0.1330 -8.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -0.0410 -6.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 1.5860 -7.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -2.6020 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -7.3380 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -7.2540 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -5.6270 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -5.7100 -0.7020 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END