BACHEM-ZINC04899798 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 57 0 0 1 0 0 0 0 0999 V2000 0.7730 0.8640 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -0.3070 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -1.5100 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -1.5550 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -0.3850 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 0.8380 0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 2.1070 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 2.6170 2.5310 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5390 1.8380 3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 3.8430 3.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 3.7470 4.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 5.0300 2.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 6.3600 3.0390 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1870 6.2420 4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 6.8560 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 7.8520 3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 8.6670 3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 9.7500 3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 7.3680 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 6.8340 2.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 2.9530 2.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 3.7960 1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 4.2090 0.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 4.3480 1.7910 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0850 4.2470 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 3.6910 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1690 4.3450 1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 3.8750 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -2.6790 -0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -2.4850 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 1.8010 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -0.2640 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.4990 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -0.4330 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 1.9060 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 2.8750 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 5.0000 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 6.0160 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 7.3100 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 8.5390 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 7.3070 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 8.0070 2.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 9.1290 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 10.4300 4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1920 9.3330 4.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 2.5490 3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 3.7690 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 2.6310 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8080 10.5740 3.3520 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1170 11.3240 3.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 11.0200 2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6330 10.0120 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 8.5830 2.5620 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8700 5.8210 1.5270 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6430 6.0440 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 6.3250 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 6.2570 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 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 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 53 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 54 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 54 57 1 0 0 0 0 M CHG 1 49 1 M CHG 1 53 -1 M CHG 1 54 1 M END