PUBCHEM-ZINC01131523 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.7020 1.5320 1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 0.1440 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -0.6750 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -0.0920 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 1.2920 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 2.1070 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 3.5790 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 4.2730 0.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 4.0880 -0.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 5.5170 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 6.1230 0.8010 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1690 5.7780 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 7.6450 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 7.9220 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 6.8150 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 5.6800 0.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -2.0740 0.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -2.9030 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -2.5320 2.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -4.3960 0.9120 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4760 -4.6560 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -5.2740 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -5.2990 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -4.8830 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -4.4100 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -4.7220 -0.5300 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0840 -5.8080 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -4.1110 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -3.4010 -1.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 2.1600 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.2670 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -0.7180 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 1.7030 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 3.4730 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 5.6370 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 5.9980 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 8.1010 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 8.0390 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 7.8130 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 8.9190 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6820 6.5500 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3010 7.0850 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -2.5560 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -6.3060 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -4.9360 2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -5.6550 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -4.8970 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -4.8980 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -3.3330 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -4.3860 -2.8550 O 0 5 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 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 28 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 M CHG 1 50 -1 M END