BACHEM-ZINC04899761 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 3.0780 -0.0820 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 0.3570 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -0.5100 0.7300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0860 -1.5630 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.2160 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.1930 2.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8680 -0.7280 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -0.6250 3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 0.1900 4.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -1.9170 3.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -2.3570 4.5150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7170 -1.5640 4.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -2.6760 5.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -3.7920 5.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 -3.5910 4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 -4.0560 3.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 1.2480 2.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 1.7530 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 1.0070 1.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 3.2440 1.7090 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6330 3.7600 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 3.7210 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 5.0360 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 4.7100 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 3.6020 0.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 3.0110 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 2.0470 -0.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 3.5490 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -1.1700 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 0.3460 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 0.2650 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 1.4020 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 0.2420 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -0.5420 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -0.7510 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 0.8550 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -2.5550 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -2.9180 6.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -1.8100 5.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -4.0510 5.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 1.8390 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 2.9980 3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 3.9170 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 5.2620 3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 5.8630 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4500 4.4090 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 5.5820 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 3.5060 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 4.5830 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 1.7630 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -4.1750 5.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 2.7380 -2.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 3.0780 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 -4.9640 4.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 51 1 0 0 0 0 17 18 1 0 0 0 0 17 41 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 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 52 1 0 0 0 0 50 52 1 0 0 0 0 51 54 1 0 0 0 0 52 53 1 0 0 0 0 M END