BACHEM-ZINC02504773 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 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 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.0250 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.7670 3.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 1.2340 2.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.7070 4.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4430 1.2580 4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 1.3060 5.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.2180 5.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 1.9350 5.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 3.2070 4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 3.8220 3.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 3.8670 5.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 5.3250 5.0340 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4650 5.6420 4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 5.7640 5.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 5.2340 5.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 3.9940 5.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4230 3.5080 5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1120 4.2600 4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6320 5.5000 3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 5.9890 4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 5.9560 5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 5.2590 5.9470 O 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 1.8280 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 1.6580 6.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -0.5690 4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -0.5030 6.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -0.6660 5.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 3.0210 5.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 1.6500 6.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 1.5840 4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 3.3750 5.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 5.3720 6.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 6.8530 5.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 3.4060 6.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7980 2.5390 5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0260 3.8800 3.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 6.0880 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 6.9590 4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -2.3540 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 7.2930 5.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.9800 1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.3300 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 7.6520 5.9640 H 0 0 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 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 53 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 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 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 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 26 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 51 53 1 0 0 0 0 52 55 1 0 0 0 0 53 54 1 0 0 0 0 M END