IBS-ZINC04023009 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.1650 -0.6340 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 0.0460 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 1.3700 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 2.0610 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -0.6450 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 0.1440 -0.4150 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 -0.8180 -0.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 0.8790 -1.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 1.3330 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 0.9850 1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 1.9140 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 3.2000 2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 3.5460 1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 2.6130 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 4.1450 3.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 5.4210 3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 5.8630 3.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1330 6.1680 4.8810 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0960 6.5220 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4200 7.2840 5.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4110 7.8060 6.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8650 6.7000 7.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 5.4780 6.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 5.0180 5.9100 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4260 4.8470 6.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5960 3.8750 4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2920 2.9050 5.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.9210 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5630 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 3.1410 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -1.5910 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -0.0150 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 1.6420 3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 4.5450 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 2.8840 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 8.0820 4.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 6.9000 6.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2830 8.2220 6.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9290 8.5930 7.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6440 7.0920 8.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0180 6.3860 8.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3040 5.7600 6.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6590 4.6820 7.5640 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 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 17 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 M END