IBS-ZINC04746215 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3430 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0390 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.7120 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -0.0030 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.3780 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0520 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 2.1510 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 3.0060 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 2.9300 -3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 3.4700 -3.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1470 2.6600 -2.8260 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1710 1.6190 -3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5730 2.7440 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5450 3.2220 -2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 4.3800 -3.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 2.4380 -2.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9450 2.9970 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5280 2.6510 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4550 1.1370 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9940 0.6850 -0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3930 1.0100 -2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -0.7240 -0.0760 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7080 -1.9420 -0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -0.1000 -0.0770 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.8690 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.5930 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -1.7920 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 3.1320 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 3.1620 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 1.6530 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 4.0440 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 2.6080 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 1.8930 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 3.5290 -4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 3.3770 -4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 4.5180 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1930 2.1570 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 3.7840 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5720 2.5670 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9030 4.0800 -2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5670 2.9760 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9530 3.1560 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0100 0.6320 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8920 0.8860 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9410 -0.3890 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 1.2090 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3270 0.7820 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8910 0.4140 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 2.2150 -1.4030 N 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 49 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 21 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END