IBS-ZINC02230037 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 3 0 0 0 0 0 0 0 0 0 3.5630 -1.7320 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -0.7040 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 -1.0590 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 -0.6170 3.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 -0.7300 4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 -0.0280 2.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 -0.0380 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 0.3680 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 0.9640 -0.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 -0.0170 -0.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 0.2160 -2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 1.5540 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 1.7970 -4.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 3.0460 -4.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -1.7830 3.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -1.1540 4.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -1.8340 4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -3.1390 4.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -3.7720 3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -3.1000 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -3.7200 1.9520 O 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 5.4600 0.2390 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 -0.5880 -2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 1.5300 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 2.3570 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 1.8200 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 0.9930 -4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 3.2660 -5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -0.1360 4.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -1.3460 5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -3.6640 4.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -4.7910 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -4.1970 2.3120 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 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 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 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 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 28 45 1 0 0 0 0 M END