CHEMDIV-ZINC07005552 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 1.3830 1.0330 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -0.4100 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.2440 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -2.4870 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -2.3870 -0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -1.0930 -0.8220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -3.7510 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -4.8960 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -5.9840 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -5.6430 2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -4.0170 3.1260 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -6.5920 4.4410 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -5.6920 5.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -7.7850 3.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -7.0920 5.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -6.0430 5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -6.7060 6.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -8.7000 5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -8.0120 4.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -8.2930 6.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8120 -8.9890 5.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 -8.2460 5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7410 -8.8920 4.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7480 -10.2820 4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 -11.0310 4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8360 -10.3890 5.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.2030 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 1.5950 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 1.4350 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.9670 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -4.9540 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -6.9690 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -5.4220 4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -5.4020 6.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -5.9510 7.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -7.2930 7.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -9.3260 5.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -9.3060 4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -8.7870 3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -7.4470 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 -8.9730 7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -7.4860 7.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 -7.1600 5.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4920 -8.3140 3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4990 -10.7840 3.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 -12.1170 4.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -10.9950 6.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -7.6630 5.8010 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1340 -7.1130 5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 48 1 0 0 0 0 19 39 1 0 0 0 0 19 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 48 1 M END