PUBCHEM-ZINC04523460 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 0.4090 1.2610 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.0400 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -0.9750 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -2.2350 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -2.4920 1.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -3.0720 -0.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -4.3410 -0.3950 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6220 -4.9120 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -4.2810 0.7340 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7370 -5.3070 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -3.6750 0.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7130 -2.6070 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3380 -4.4210 -1.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2250 -3.9250 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2340 -4.5100 -2.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0330 -3.5110 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -5.0220 -1.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6260 -5.4310 -3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 -5.3980 -4.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -5.6020 -3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -5.7270 -0.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 -5.5750 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -3.7860 1.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -3.5100 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -3.5670 1.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -3.2220 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 2.1810 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 3.4970 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 1.0380 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 1.7710 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -0.5500 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 0.1900 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -0.4720 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -1.2640 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -2.8300 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -6.4720 -2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5580 -5.1070 -3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 2.3780 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 1.6740 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 3.3520 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 4.0580 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 4.3450 1.0080 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4300 5.2570 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 3.9030 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 4.5210 1.7980 H 0 0 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 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 38 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 42 1 M END