PUBCHEM-ZINC04854655 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.3530 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -3.7220 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5660 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.0410 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6730 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -6.3120 1.7920 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -6.8680 0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -6.5350 2.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -6.8210 2.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -7.2190 1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -6.4220 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -6.6160 4.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -6.0900 4.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -6.8880 4.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 -5.8610 4.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 -5.2300 3.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 -5.8870 5.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1530 -5.1530 6.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -5.3480 8.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1980 -6.4090 8.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4380 -4.6530 8.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 -4.0840 9.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -4.5020 10.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -4.6920 8.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -1.6940 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -4.1340 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -4.7020 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -2.2640 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -7.0060 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 -8.2850 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -5.3640 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -6.7760 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -7.6770 4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -5.0350 4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -6.2070 5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -7.9280 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -6.4570 4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -6.3920 6.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -4.0930 6.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0770 -5.5290 6.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7770 -3.8480 7.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2380 -5.3750 8.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 -2.9980 9.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4930 -4.5250 10.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8550 -3.7140 10.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 -5.4340 10.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 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 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 47 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 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 M END