PUBCHEM-ZINC04591762 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 2.2160 -2.0310 -0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -0.3540 -1.3010 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 0.6020 -0.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -0.1780 -2.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.3140 -1.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 0.0480 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 1.5200 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 1.9570 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 3.3070 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 4.2200 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 3.7830 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 2.4330 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -0.6250 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -1.9050 -2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -2.2110 -4.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -1.2480 -5.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 0.0260 -4.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 0.3540 -3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.7180 -3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 1.9740 -2.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 2.6810 -4.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 4.0360 -4.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2280 4.2710 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 4.1210 -4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 5.5370 -4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 6.5380 -5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 6.4520 -4.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 5.0370 -4.9080 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4810 4.8020 -5.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 4.9580 -4.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -2.2500 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -2.7490 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 -2.1020 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -0.5260 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -0.1720 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 1.2440 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 3.6490 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 5.2750 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 4.4960 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 2.0910 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -2.6610 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -3.2080 -4.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -1.4990 -6.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 0.7720 -5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 2.4760 -5.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 3.4080 -3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 3.8860 -5.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 5.7720 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 5.5970 -4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 7.5460 -4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 6.3020 -6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 6.6880 -3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 7.1660 -5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 5.5660 -4.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 54 1 0 0 0 0 M END