PUBCHEM-ZINC01078816 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 2.8820 2.0960 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 0.8440 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 -0.2770 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -0.1450 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 1.1070 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 2.2270 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2220 4.4180 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 5.7720 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 5.8360 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 5.1860 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 3.7370 2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 3.7230 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 3.1740 3.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 6.7720 0.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 4.2870 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 4.8040 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 5.5020 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 6.1500 -2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 5.0680 -3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 4.3720 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 3.8840 -2.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 4.6970 0.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -1.6180 0.9510 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4070 -1.7330 1.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -2.6050 0.4740 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3500 2.9710 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3150 0.7410 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -1.0210 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 1.2090 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 3.4890 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 6.8770 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 5.3000 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 5.7400 3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 5.2020 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 3.2860 3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 3.1740 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 4.5470 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 6.2710 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 4.7770 -2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 6.9060 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 6.6140 -3.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 5.5260 -4.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 4.3410 -4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 5.0810 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 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 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END