BACHEM-ZINC04899863 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 0.1160 1.6860 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 0.1660 -0.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7860 -0.1040 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -0.4900 -0.5160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2680 -1.1980 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 0.5940 -0.8350 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2560 0.8980 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 2.0080 0.1800 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 0.1720 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 1.1990 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 0.6940 -0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 1.7110 -1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7370 1.2210 -1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0280 0.1290 -0.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6550 2.1350 -1.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0850 1.8930 -1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8010 3.1040 -2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1870 4.0880 -2.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1670 2.9820 -2.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0710 4.0100 -2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5530 3.5960 -2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7340 2.4480 -2.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -1.2820 0.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -1.2510 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -1.8520 2.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -0.4290 1.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 2.1540 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 2.1240 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -0.0160 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 -0.7790 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 1.4040 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 2.1470 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4930 0.4800 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4100 -0.2530 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 1.9200 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2100 2.6540 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3570 3.0280 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3960 1.7350 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3070 1.0000 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6600 2.1570 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8130 4.1950 -3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8970 4.9280 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -1.8280 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.2870 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3870 4.4410 -3.2210 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 44 1 0 0 0 0 M CHG 1 45 -1 M END