CHEMSTAR-ZINC04014680 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 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 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0230 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4040 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4870 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 4.2750 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 5.6010 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 5.5530 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 4.2850 -0.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 6.7100 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 7.8390 -0.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 6.7590 0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 7.7720 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 8.9130 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 9.9390 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 11.2070 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 11.8800 -1.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 11.1510 -2.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 9.9780 -1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 9.1120 -2.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 11.5760 -3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 12.8070 -3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 13.2230 -5.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 12.4150 -6.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 11.1890 -5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 10.7650 -4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 12.9500 -7.9220 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 12.2470 -8.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 14.3680 -7.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 11.6370 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 10.9170 2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 3.8530 1.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.4420 -0.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -2.8320 0.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.8600 0.5320 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 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -0.5080 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 1.9530 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 6.8490 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 7.6820 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 9.0020 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 13.4380 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 14.1800 -5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 10.5610 -6.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 9.8050 -4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 3.7390 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 6.5160 -1.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 12.4560 -8.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 12.8290 1.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.8860 -1.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -3.8450 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 13.0680 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 12.6980 -9.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 7.3060 -2.0000 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 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 50 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 51 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 34 49 1 0 0 0 0 35 36 2 0 0 0 0 35 37 2 0 0 0 0 35 53 1 0 0 0 0 50 57 1 0 0 0 0 51 56 1 0 0 0 0 52 55 1 0 0 0 0 53 54 1 0 0 0 0 M END