IFLAB-ZINC01805625 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3890 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 1.1790 -0.6890 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 0.0160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.4330 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 2.1060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 2.1380 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 1.4560 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 0.0640 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -0.6580 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -2.0150 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -2.6270 -1.4360 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 -4.0280 -1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -1.8370 -2.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -2.3910 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 -3.3510 -1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5330 -3.1760 -2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8290 -2.0330 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -1.0640 -3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 -1.2520 -2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4280 -0.0490 -4.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 0.7620 -4.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7090 -0.3840 -4.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5010 0.2890 -4.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 -1.5750 -3.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8340 -2.0360 -3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 3.1850 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 3.2180 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 2.0030 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 -0.4530 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 -4.2420 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2930 -3.9260 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -0.5070 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 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 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 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 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 M END