BACHEM-ZINC04899864 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 0.0810 2.2940 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 0.5010 0.3050 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 0.0820 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -1.4220 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -1.7750 -0.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7820 -1.1670 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -3.2340 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -3.9780 0.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -1.5130 1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 -1.2570 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9250 -1.2440 0.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 -0.9920 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 -1.0060 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7300 -0.7590 4.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 -0.4960 5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8550 -0.4800 3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2620 -0.7220 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2270 -0.2140 3.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0760 -0.8050 3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6660 -1.6380 2.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5360 -0.4290 3.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.6340 0.6470 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2480 -1.1590 4.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0050 -0.7070 4.2340 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 2.6620 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 2.7820 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 2.5170 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 0.3600 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 0.6250 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -1.7000 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -1.9650 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -1.5230 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 -1.2110 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1370 -0.7700 5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5480 -0.3030 5.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8580 -0.7040 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5660 0.3960 4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1500 -2.2360 4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7970 -0.8740 5.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4960 -1.4110 5.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0650 -1.8070 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 -3.7070 -1.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1430 -0.8130 1.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.1060 -0.5140 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -4.6490 -1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 43 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 41 43 1 0 0 0 0 42 45 1 0 0 0 0 43 44 1 0 0 0 0 M END