IFLAB-ZINC04110682 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2190 -0.5500 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 0.7210 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 1.9580 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.0290 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -2.5010 -1.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -3.8000 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.5780 -0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -4.2870 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -5.7880 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -6.2820 -4.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 -5.5380 -5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1270 -4.0360 -5.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -3.5430 -3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 -6.0320 -6.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 -5.4080 -7.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 -6.0200 -8.8120 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2940 -5.1860 -9.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -7.4230 -8.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -5.7900 -10.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -4.7150 -10.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -4.7580 -11.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -5.8690 -11.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -6.9470 -10.3720 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 1.9480 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -0.5970 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 3.0240 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -2.2170 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.5580 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -1.8790 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -4.0980 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -5.9760 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -6.3180 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -7.3520 -4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -6.0940 -5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 -5.7260 -4.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -3.5070 -5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -3.8480 -5.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -2.4730 -3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 -3.7310 -3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -7.1150 -6.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -5.7640 -7.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -4.6370 -6.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -3.8730 -10.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -3.9540 -12.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -6.0770 -12.1860 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 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 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 M END