PUBCHEM-ZINC06779241 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.2440 0.3480 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -0.9650 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 -0.8110 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -2.1280 0.4770 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3680 -2.8810 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -1.9110 1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -2.3260 2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -3.9900 0.9140 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0160 -3.9080 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -5.1160 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -4.2210 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -3.7220 2.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -5.0120 1.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -5.3780 2.2630 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6360 -5.9860 3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -4.2350 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 -3.5800 2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -4.6250 1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 -5.6300 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -6.2950 1.4060 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3860 -7.1090 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -6.8470 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 -5.6710 0.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1130 -6.0590 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -4.7470 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -3.5370 -1.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 0.2180 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 0.7030 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 1.1230 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -1.7240 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -1.3020 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.0740 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -0.3940 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -5.1350 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -5.0150 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -6.0940 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -3.4570 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 -4.6550 3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -3.0580 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4590 -2.8260 2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7330 -4.1390 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3870 -5.1370 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -5.1110 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9290 -6.4070 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -7.2510 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -7.6660 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3370 -1.3990 1.0250 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9270 -2.6770 1.2930 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2020 -1.9700 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -2.7740 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -5.3160 -2.0630 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 48 1 0 0 0 0 6 7 2 0 0 0 0 6 47 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 48 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 47 -1 M CHG 1 48 1 M CHG 1 51 -1 M END