CHEMDIV-ZINC06942956 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5380 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 0.2310 -0.5480 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -0.1310 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 1.2680 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 2.3350 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 2.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 1.3880 -3.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 2.3120 -4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 3.0440 -4.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 2.4360 -5.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9280 2.6730 -5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 1.1130 -6.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 1.2270 -7.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 2.3280 -8.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 3.5710 -7.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 3.5510 -6.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 4.9690 -8.4750 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 5.7850 -7.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 4.5770 -9.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 5.7500 -9.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 6.7320 -8.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 7.1680 -10.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 5.9880 -11.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 5.5810 -10.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.9020 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.8930 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -0.3500 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -0.3720 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -1.6360 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -0.1960 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -0.1570 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -0.8120 -2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 1.4500 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 2.3860 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 3.3030 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 2.9470 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 1.2790 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 0.8030 -3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2570 0.3140 -5.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 0.8880 -6.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8160 1.4760 -7.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 0.2770 -8.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 2.4810 -9.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 2.0380 -9.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 3.3620 -6.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 4.5110 -6.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 6.2750 -8.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 7.5950 -8.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 7.2800 -9.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 8.0930 -10.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 5.1720 -10.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 6.3200 -12.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 6.2350 -11.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 4.5410 -11.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 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 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 M END