IBS-ZINC01791386 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7720 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0790 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6920 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0080 -2.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.7810 -3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 0.1550 -4.7880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7650 0.8550 -4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.6670 -6.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 0.2350 -7.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 0.7560 -7.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 0.6340 -7.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -0.0610 -6.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 1.2930 -8.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 1.2110 -8.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 2.0630 -9.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 2.6420 -9.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 2.2070 -9.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 1.5550 -8.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 1.5040 -8.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 0.7210 -7.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.3620 -7.6800 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 1.3350 -9.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8430 1.1770 -8.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3550 0.4760 -8.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 1.8150 -9.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 3.0550 -10.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 0.8800 -4.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6280 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8520 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6170 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -1.3980 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.4220 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -1.2880 -6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -1.3040 -6.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 2.3860 -8.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 0.9840 -9.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 2.3760 -10.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 1.7130 -9.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 3.4810 -11.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 2.4560 -11.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 3.8590 -10.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 0.3200 -4.8520 H 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 22 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 M END