CHEMSTAR-ZINC02059773 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.5900 1.3130 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -0.0970 -0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -0.5590 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.9120 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -2.3510 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -1.5510 3.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -0.2530 3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 0.2970 2.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 0.5300 4.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 1.8450 4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -3.7370 2.6900 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -4.2910 3.9010 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -5.7360 3.7810 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 -3.5430 3.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -3.9070 5.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -4.6150 5.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.2980 6.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -3.2860 7.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -2.5960 7.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -2.9100 6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -3.0620 8.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.1430 9.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -1.2720 9.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -2.1970 11.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -1.0070 11.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -0.9230 13.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -2.0320 13.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -3.2160 12.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -3.3190 11.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -4.6320 10.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -4.5620 9.6350 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4930 1.8500 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 1.5770 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 1.6190 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -2.5700 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 2.4060 3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 1.8320 3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 2.3640 5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -4.4090 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -5.4040 5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -4.8550 7.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -1.8130 8.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -2.3560 5.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -3.6990 9.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -0.1260 11.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 0.0040 13.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -1.9800 14.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -4.0830 13.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -5.6880 11.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 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 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 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 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 30 1 0 0 0 0 30 31 1 0 0 0 0 30 49 2 0 0 0 0 M CHG 1 31 -1 M END