IBS-ZINC04088902 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3470 -1.4700 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -1.7910 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 -1.3620 -2.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 0.3350 -2.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 0.4440 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -0.5210 -4.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 1.7660 -4.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6040 2.0720 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 2.8210 -3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 3.2640 -5.0500 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 1.7640 -6.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4190 0.9010 -5.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 1.5980 -5.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 1.3680 -6.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 0.8770 -6.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 1.7990 -7.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 2.0600 -7.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 2.4960 -8.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 2.6640 -9.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 2.3950 -10.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 1.9660 -9.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 1.1060 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 2.3930 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 3.6920 -3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 2.7070 -8.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 3.0060 -10.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 2.5220 -11.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 1.7500 -9.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 -3.0170 -0.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -3.5190 -0.9910 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 3 32 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 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 44 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 28 29 1 0 0 0 0 28 42 1 0 0 0 0 29 43 1 0 0 0 0 44 45 1 0 0 0 0 M END