PUBCHEM-ZINC02137210 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 0 0 0 0 0 0999 V2000 -0.0370 1.5160 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.1800 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -0.6110 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -1.6750 1.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -2.8600 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -3.8930 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -5.0550 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -1.3220 2.5310 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -2.5570 3.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2950 -0.3920 2.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -0.4460 3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -1.1490 4.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -0.4450 4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 0.9550 4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 1.6370 4.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 0.9400 3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 1.5910 5.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 2.9530 5.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 3.8530 5.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 3.2380 6.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 4.4870 6.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 4.7750 6.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0730 3.7770 7.4350 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8550 2.1250 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 2.0300 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.3680 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -1.0700 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 0.0320 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -3.2530 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -2.6190 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -3.6730 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -5.7620 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -5.3160 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -2.2330 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -1.0050 5.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 2.7170 4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 1.4940 3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 0.9730 5.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1990 2.4130 6.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 5.3290 5.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7790 5.9960 6.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 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 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 2 0 0 0 0 M CHG 1 23 -1 M END