IFLAB-ZINC04850485 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -4.7830 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -6.3680 -0.3870 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -6.5530 -0.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -6.6360 -1.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -7.3530 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -7.6950 1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -8.4680 2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -8.9090 2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -8.5570 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -7.7780 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -9.1530 1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -9.9200 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -9.7580 3.6560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -10.2970 4.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -10.8480 5.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -10.1970 4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -8.8560 4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -4.1920 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -7.3560 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -7.4990 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -9.8370 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -8.3640 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -10.9760 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -9.4910 3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -10.9940 4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -10.3360 5.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -8.0900 5.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -8.9310 4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END