PUBCHEM-ZINC02016422 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.8700 2.7900 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 2.5310 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 3.1070 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 3.7340 3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 3.1590 2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 3.4760 4.8690 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6050 3.0260 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 4.9570 4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 5.5010 5.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 5.8380 5.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 6.3070 6.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 6.4370 7.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 6.1160 8.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 5.6660 7.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 5.3470 7.5290 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 3.6430 7.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 2.9730 6.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 1.6150 5.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 0.9380 6.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 1.6070 8.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 2.9400 8.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -0.4950 6.7740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1620 -1.0790 5.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -1.0900 7.6570 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2260 2.9410 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 1.7290 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 3.3480 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 1.4770 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 2.6340 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 4.1540 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 2.5470 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 3.6310 4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 4.7890 3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 3.7190 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 2.1120 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 5.4320 4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 5.1980 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 5.7350 4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 6.5730 5.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 6.7900 8.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 6.2120 9.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 1.0830 5.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.0890 8.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 3.4640 9.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 3.2640 1.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 3.0020 3.6610 N 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 45 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 46 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 46 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 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 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END