CHEMDIV-ZINC05058485 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -2.7450 -3.3620 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -3.1700 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -3.1540 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -2.5750 2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -2.4950 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -1.9650 1.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9210 -0.8710 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -2.4230 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -1.9670 1.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -0.6400 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 0.2410 1.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -0.3120 2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -1.4140 2.6490 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 -2.7360 2.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 -1.1570 1.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 -0.8510 3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -1.7720 4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7210 -1.9190 3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 -2.9190 4.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6500 -3.3210 5.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5080 -2.6640 5.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1220 -4.4420 5.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 -5.2010 6.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 -6.3010 7.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8130 -6.6650 7.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8040 -5.9220 6.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4800 -4.8020 6.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6120 -4.0450 5.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 -1.2840 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -3.8120 -3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -4.0270 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -2.4060 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -4.1280 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -2.5540 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -4.2250 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 -2.9510 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -1.5750 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -3.2020 3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -1.8400 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -3.4930 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -3.5160 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -2.0360 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -2.6580 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 0.7050 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -0.4060 3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 0.1540 3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 -0.7900 4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 -4.9370 6.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7020 -6.8730 7.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0840 -7.5240 8.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8420 -6.2230 7.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5150 -2.9700 5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5810 -4.3460 5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6380 -4.2400 4.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4090 -1.1740 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1490 -1.8920 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9060 -0.2890 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -2.4330 0.0670 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4090 -1.5640 -0.2550 H 0 0 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 33 1 0 0 0 0 2 34 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 58 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 58 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END