SIAL-ZINC04534066 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 -0.0110 1.5090 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0210 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5170 -0.3800 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -0.5130 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.8930 2.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -0.5300 1.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -1.0090 2.4290 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2300 -0.7260 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -2.5320 2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 -0.3910 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 0.3730 1.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 -0.6880 3.4940 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -0.0880 3.5430 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7200 0.0210 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 1.2870 4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4280 2.2120 3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 2.2960 3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 3.1450 2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 3.9100 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 3.8260 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 2.9810 2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 -0.9770 4.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 -2.0090 4.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5420 -0.6240 4.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3720 -1.3970 5.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2170 -2.7760 5.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0370 -3.5370 6.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0120 -2.9260 6.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1690 -1.5530 6.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3560 -0.7880 6.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8900 -3.7450 7.8250 N 0 3 0 0 0 0 0 0 0 0 0 0 11.7530 -4.9540 7.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7490 -3.2080 8.5020 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0120 1.8840 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.8650 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.8680 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.2260 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -2.8880 3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -2.9790 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -2.8150 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -1.3000 4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 1.1900 5.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 1.6950 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 1.6990 4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 3.2100 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 4.5720 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 4.4240 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1120 2.9180 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8940 0.1670 4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4550 -3.2540 4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9170 -4.6100 6.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9320 -1.0790 7.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4820 0.2840 6.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -0.2080 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5270 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -0.2640 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 55 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 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 22 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 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 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 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 31 1 M CHG 1 33 -1 M END