PUBCHEM-ZINC03040432 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1610 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9910 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -2.8130 -0.0470 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1250 -4.0280 -0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -2.2740 0.9020 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5040 -2.5030 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -2.7160 -4.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0860 -3.2730 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 -3.4940 -5.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -3.0120 -5.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -1.4170 -3.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 -1.0980 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 0.2090 -2.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 0.5580 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 1.7820 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 2.6700 -2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5330 2.3380 -3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 1.1090 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3080 0.7790 -4.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2390 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.1430 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -3.4670 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -1.8720 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -1.7900 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -0.1320 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 2.0500 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6380 3.6280 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 3.0360 -4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 1.0390 -4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 -4.7220 -5.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -5.1820 -6.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END