IBS-ZINC06624567 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 49 0 0 0 0 0 0 0 0999 V2000 -0.0630 1.5150 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 0.0970 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -0.4910 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 0.2090 2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 -0.4780 3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -1.8780 3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.5960 2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -1.9000 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -2.5810 0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -2.7000 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -4.1030 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -4.8120 1.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -4.7460 3.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -6.0850 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -7.2510 2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -8.4930 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -8.5820 4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -7.4100 5.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -6.1420 4.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -4.8000 5.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -3.9830 4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -2.6010 4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -1.9970 5.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 -2.7800 6.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -4.1750 6.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0710 -9.7420 5.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -10.9750 4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -12.1460 5.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -12.5650 5.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 1.9860 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 1.8050 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 1.8690 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 1.2930 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 0.0950 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -3.1320 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -3.3740 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -1.7330 -1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -7.2040 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -9.3830 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -7.4850 6.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -2.2320 7.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 -4.7390 7.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -11.0440 4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -11.0460 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -12.5790 6.3800 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 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 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 M CHG 1 45 -1 M END