PUBCHEM-ZINC05759901 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 59 0 0 1 0 0 0 0 0999 V2000 -0.6320 1.8740 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 0.3480 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -0.1350 2.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -0.3320 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.0860 -0.8510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9330 0.9800 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 -0.6740 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 -1.7310 -1.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 0.0800 -0.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7130 -0.3210 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 0.5210 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1010 0.1820 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6540 0.0420 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0000 -0.2980 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7980 -0.5000 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2560 -0.3550 -1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9120 -0.0100 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 -1.7380 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6420 -2.0500 -2.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 -2.5980 -0.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 -4.0450 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1300 -4.7400 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 -3.9530 1.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.7800 -1.6460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -0.1950 -2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 0.9730 -1.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -1.1490 -2.8710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3970 -1.9750 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -1.6770 -4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -1.2530 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 2.3300 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 2.2660 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 2.2100 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 0.0570 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 0.1270 3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -1.2220 2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 0.3160 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -1.4160 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -0.0030 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 1.0100 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4470 1.5400 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0400 0.1830 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4220 -0.4160 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8410 -0.7790 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8760 -0.5230 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4980 0.0830 -2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2400 -2.2720 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9000 -4.2750 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4100 -4.3950 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -1.7470 -1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -2.2770 -3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -0.8560 -4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -2.3160 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 -2.0840 -3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 -1.6520 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 -0.6630 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0310 -5.9950 0.8270 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3820 -0.4060 -3.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 0.3640 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 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 40 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 46 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 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 57 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 58 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 58 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 57 -1 M END