PUBCHEM-ZINC06616366 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 0.1740 1.7360 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 0.2100 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -0.2180 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -0.4040 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.1300 2.4660 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1370 0.9440 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -0.7840 3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -1.9350 4.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 0.0830 4.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -0.4400 5.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -0.6890 2.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -0.1600 3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 0.8920 3.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -0.8920 2.9640 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -2.2520 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -3.1800 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 -1.1780 4.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8610 -0.2970 3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 -3.4820 5.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 2.1720 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 2.1470 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 2.0700 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -0.1760 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 0.1450 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -1.3100 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 0.1750 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -1.4910 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -0.0350 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -0.7120 6.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -1.3030 5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 0.3400 5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -1.4900 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -2.1820 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 -2.6880 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 -4.1560 3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -3.3080 4.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -1.2660 5.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4030 -0.7930 4.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 0.7090 3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5840 -0.1960 2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5770 -3.5790 5.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4800 -4.4530 4.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2190 -3.0290 5.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 -2.5860 4.1060 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.3640 -2.5130 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 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 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 44 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END