IBS-ZINC02421411 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 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 -1.5470 -6.1500 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -6.6370 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 -7.9320 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -8.7960 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -10.1820 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -11.0390 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -10.5610 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -9.2230 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -8.3100 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -6.9880 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -5.7430 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4950 -6.3060 0.0260 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3350 -5.1620 0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 -7.2860 -1.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 -7.1620 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -6.6100 2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2650 -7.4810 3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 -8.7410 3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 -8.8770 1.8030 S 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 -2.0600 -4.1640 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 -10.5670 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -12.1050 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -11.2600 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -8.8660 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 -4.7880 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4090 -5.5610 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6020 -7.1640 4.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 -9.5540 4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 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 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 43 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 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 M END