SIAL-ZINC04535990 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 66 0 0 1 0 0 0 0 0999 V2000 0.7970 1.4130 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.0490 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -0.9220 0.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -0.2800 0.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -1.6270 0.1070 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7760 -2.3250 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -1.6830 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -3.1010 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -4.0390 0.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -1.9850 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -1.1740 -2.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -3.3060 -1.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -3.9380 -2.9650 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5060 -5.0070 -2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -3.7630 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -4.2660 -2.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -5.6290 -2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -6.0880 -1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -5.1890 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -3.8320 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -3.3740 -1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1420 -5.6740 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -4.9740 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -3.4490 -3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -2.7110 -3.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -3.9600 -5.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4670 -3.6170 -6.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4040 -3.3930 -5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -2.4320 -7.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 -1.1330 -6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 0.2790 -7.3310 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 1.5500 -6.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -4.8770 -6.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -5.5960 -7.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 -5.1290 -7.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -6.3110 -8.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8360 -6.4430 -8.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5970 -5.5060 -7.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3000 -7.6840 -8.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3030 -7.8250 -8.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7010 -8.4730 -8.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 1.5300 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 1.8420 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.9470 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 0.5030 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -1.1290 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -1.2030 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -3.8670 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -4.3050 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -2.7160 -3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -6.3440 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 -7.1450 -1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -3.1180 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -2.3120 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -4.6120 -5.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -2.6540 -7.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -2.3130 -7.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -0.9300 -5.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -1.2040 -5.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 1.6470 -5.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 1.3020 -5.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 2.5100 -6.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 -4.4950 -7.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 -6.2050 -9.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -7.1910 -7.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 -3.1590 1.4420 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 2 0 0 0 0 8 66 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 48 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 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 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 M CHG 1 66 -1 M END