BACHEM-ZINC04899877 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 67 0 0 1 0 0 0 0 0999 V2000 -1.2440 -2.4360 -1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -1.3300 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -1.6530 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 0.0580 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 0.5740 -1.8100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7100 -0.1650 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 0.9840 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 2.1300 -1.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -0.0530 -1.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -0.0320 -1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 1.0760 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6260 1.0100 -0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3130 -0.1630 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6140 -1.2740 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 -1.2090 -1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 1.7800 -2.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 1.7210 -3.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 0.6630 -3.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 3.0860 -3.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6250 3.7430 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 3.7110 -4.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 5.1900 -4.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 2.9570 -5.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 2.7140 -2.5730 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5010 2.4040 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 4.1370 -2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 4.8420 -3.4100 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0790 1.6090 -2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 0.2870 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -0.7610 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 -0.5060 -3.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 0.7960 -3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 1.8450 -3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -3.4180 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -2.3070 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -2.4550 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -1.3160 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -1.6940 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -0.8940 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -2.6210 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 0.7880 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.0290 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -0.9340 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7460 2.0090 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1700 1.8780 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3910 -0.2100 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1460 -2.1910 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7080 -2.0920 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 2.6680 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 3.6700 -4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 5.3250 -5.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 5.6470 -5.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 5.7450 -3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 1.9010 -5.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 3.3850 -6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 3.0130 -6.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 4.5150 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 3.9680 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 0.0590 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 -1.7750 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 -1.3200 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 0.9980 -4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 2.8510 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 2.9610 -3.7230 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3380 2.2960 -4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 3.8970 -4.0030 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 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 64 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 24 64 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 64 65 1 0 0 0 0 64 66 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 64 1 M END