BACHEM-ZINC04899553 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 -0.3170 1.6130 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 0.0890 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -0.4850 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -0.5360 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -0.3110 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 0.0630 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 0.7550 -0.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -0.4700 -2.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -0.3070 -2.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4950 0.6800 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0410 -1.4080 -1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 -1.3300 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -2.3010 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -3.0350 -0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -2.2900 1.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4540 -2.9090 2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2160 -1.6920 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 -0.3630 -3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -0.8890 -4.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 0.1850 -4.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 0.9320 -3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 1.8140 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1390 0.9190 -6.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 0.0800 -5.9220 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0200 0.5050 -6.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2020 -1.3290 -6.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4130 -2.2390 -5.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 2.1090 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 2.0120 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 1.9080 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -0.3230 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -1.5610 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -0.0260 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -0.1770 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -1.6260 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -0.3030 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -1.0090 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6860 -2.3970 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 -1.3440 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -0.3200 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -1.5540 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 1.5160 -2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3200 0.2150 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 2.6910 -5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 2.1620 -4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 1.5030 -7.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 0.2950 -6.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 -1.3880 -7.7520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 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 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 48 -1 M END