SIAL-ZINC04543983 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3500 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 1.2000 -0.6540 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.0420 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -0.5560 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 1.3740 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 2.0500 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 3.4250 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -2.1190 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7510 -2.4900 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -2.6340 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -3.9010 -1.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7670 -4.7800 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.0010 -0.5770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3760 -4.6630 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -2.6520 -0.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -4.5040 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -4.7010 -0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -3.7490 -2.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -4.7490 -4.1920 P 0 0 3 0 0 0 0 0 0 0 0 0 2.2640 -4.8180 -4.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.2040 -5.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -4.8150 -6.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -4.0510 -7.8240 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6610 -3.9800 -7.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -4.7440 -9.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4260 -5.3710 -9.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -3.5740 -10.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -2.3120 -9.3220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6250 -1.9730 -9.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -2.7330 -8.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -1.2470 -9.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -0.9660 -9.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 0.0430 -10.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 0.4680 -11.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -0.3560 -10.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -0.1550 -11.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 2.3360 -13.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 0.8050 -12.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 1.6380 -12.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 1.5000 -12.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 2.2390 -12.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 0.9730 -13.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -5.5210 -9.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.8860 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 0.3820 3.9170 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 3.9040 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -1.8910 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -2.8860 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -3.7680 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -5.4490 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 -5.0200 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -4.7900 -7.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -5.8490 -6.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -3.5860 -10.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -3.6220 -10.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -1.5000 -8.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 0.3870 -12.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 1.6760 -13.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -5.9780 -10.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -6.2170 -3.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -6.2460 -3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 62 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 44 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 32 33 1 0 0 0 0 32 36 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 35 41 1 0 0 0 0 36 37 1 0 0 0 0 37 39 2 0 0 0 0 38 40 1 0 0 0 0 39 40 1 0 0 0 0 39 43 1 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 43 59 1 0 0 0 0 43 60 1 0 0 0 0 44 61 1 0 0 0 0 62 63 1 0 0 0 0 M END