BACHEM-ZINC04899572 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -1.2130 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.6470 2.6130 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3830 -1.6520 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 -0.6760 2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 0.6570 2.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 0.2730 3.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 1.2350 3.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.6430 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -0.3410 -2.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -1.1640 -1.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0020 -0.7420 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -2.6900 -1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -3.2100 -0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 -5.0180 -0.7410 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6110 -5.4390 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 -0.7790 -2.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -1.1900 -3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 -1.8800 -3.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 -0.7940 -4.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 0.4060 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 -1.1200 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 -1.2700 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 0.7140 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -3.1170 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -2.9790 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3350 -2.7830 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4540 -2.9200 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7200 -6.5200 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0260 -4.9560 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 -5.0940 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -0.2280 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 0.1470 -5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -1.5700 -5.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 -0.6720 -4.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 0.0240 4.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 0.6420 5.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 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 13 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 45 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 45 46 1 0 0 0 0 M END