IBS-ZINC06719531 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3740 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 1.2370 -0.5510 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 0.7280 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 1.9570 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -1.9940 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -2.5260 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -3.8380 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -4.4810 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -3.2800 -0.0100 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -4.5740 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -4.0940 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 -4.8080 -1.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1640 -4.7770 -2.6220 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3330 -5.5230 -2.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -5.0870 -3.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6860 -3.1100 -2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8590 -2.6660 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2710 -1.3600 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5080 -0.4890 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3300 -0.9360 -3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9240 -2.2500 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5700 -0.1010 -4.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8120 1.3030 -4.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 1.5350 -4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9220 0.7970 -3.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.9410 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.5990 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 3.0230 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -5.5530 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -4.3770 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -5.6440 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 -4.2910 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -3.0230 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5070 -5.3000 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4550 -3.3420 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1880 -1.0150 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -2.6000 -4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3360 1.8460 -5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4100 1.6460 -3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7300 1.1860 -5.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5410 2.5970 -4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 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 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END