SIAL-ZINC04544937 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 63 0 0 1 0 0 0 0 0999 V2000 0.1930 1.8640 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 0.3520 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -0.1090 0.9480 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8330 -1.0260 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 1.0070 0.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 2.2140 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 0.8640 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 -0.2090 1.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 2.0930 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -0.3600 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 0.3220 3.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -1.4320 2.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -1.8520 3.8200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2250 -1.5830 4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -3.3640 3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -4.2210 3.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -5.7020 3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -6.5760 3.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -7.9190 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -8.6940 2.7390 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0870 -8.3050 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -9.6930 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -1.1060 4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -0.7460 3.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -0.9340 5.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -1.1850 6.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -0.2770 7.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -0.3120 7.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 -0.4240 5.6250 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7220 0.5580 5.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8190 -1.3370 5.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -2.5860 5.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 2.4020 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 2.1070 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -0.0990 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 0.1310 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 2.4320 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 3.0630 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 2.2870 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0550 2.9720 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -1.9250 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -3.6490 4.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -3.6060 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -3.9590 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -4.0350 4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -5.9980 4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -5.8590 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -6.1940 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -2.2410 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -0.9620 6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -0.6050 8.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 0.7450 7.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -1.1760 7.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 0.5840 7.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 1.8090 1.9920 N 0 3 0 0 0 0 0 0 0 0 0 0 6.5730 2.3670 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 0.8010 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5830 1.9510 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -8.5010 3.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -7.9570 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -9.4960 3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8930 -0.7180 4.9650 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 55 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 62 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 M CHG 1 20 1 M CHG 1 55 1 M CHG 1 62 -1 M END