IBS-ZINC05351144 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0050 0.5570 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -0.7100 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -1.0210 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -0.0640 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 1.2040 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 1.5130 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 -0.4020 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -1.0630 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 -1.4640 -1.7880 P 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 -2.6300 -0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -2.1090 -3.5410 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2080 -1.2440 -4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9380 -2.9640 -3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -2.6060 -5.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -3.3890 -5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -4.5380 -4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -4.9110 -3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 -4.1270 -3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -5.5050 -5.3120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -2.1190 -3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7900 -2.9760 -3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3360 -3.5980 -4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4680 -4.4070 -4.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0580 -4.6080 -3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5160 -4.0040 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3840 -3.1950 -2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 -0.1580 -1.7520 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0480 0.7980 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -1.4590 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -2.0130 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 1.9560 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 2.5000 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 0.5070 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -1.0610 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 -1.9790 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -0.3980 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -1.7150 -5.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -3.0980 -6.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -5.8070 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -4.4260 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6350 -1.3000 -3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 -1.6580 -4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8730 -3.4610 -5.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8850 -4.8850 -5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9360 -5.2400 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9680 -4.1680 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9570 -2.7390 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 -2.9290 -3.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4030 -3.3120 -2.5780 H 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 48 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 27 -1 M END