SIAL-ZINC04513878 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 68 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 3 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 1.1220 -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 -3.7240 -5.2270 -0.3770 P 0 0 3 0 0 0 0 0 0 0 0 0 -4.3910 -4.3470 -1.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -5.2040 1.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 -5.5150 1.0890 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3370 -5.7470 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7200 -4.3420 1.7240 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5040 -3.9960 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3340 -4.9500 3.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3520 -5.2910 2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 -6.0710 3.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 -6.6950 2.0570 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.0150 -7.3020 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9650 -7.5140 2.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -7.4040 3.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -8.2880 2.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -9.0180 1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -8.5340 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -9.0940 0.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 -10.0920 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -10.5820 0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -10.0800 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -10.6030 1.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3220 -3.9250 4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9980 -4.4650 5.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 -3.2700 2.0510 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 1.8380 -1.6590 -2.3440 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 -1.6620 -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 -4.0110 -6.6900 3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -10.5250 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -10.2360 2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -11.3360 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2920 -3.6900 4.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8290 -3.0160 3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0290 -3.8680 6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2700 -2.5070 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -3.6230 -3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -1.9300 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -6.7310 -0.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -7.3640 -0.3520 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 47 1 0 0 0 0 2 3 1 0 0 0 0 2 48 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 49 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 46 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 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 63 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 44 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 42 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 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 53 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 38 54 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 55 1 0 0 0 0 41 56 1 0 0 0 0 42 43 1 0 0 0 0 42 57 1 0 0 0 0 42 58 1 0 0 0 0 43 59 1 0 0 0 0 44 60 1 0 0 0 0 45 61 1 0 0 0 0 46 62 1 0 0 0 0 63 64 1 0 0 0 0 M END