PUBCHEM-ZINC06482264 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 1.8270 -1.3290 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -0.9980 0.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -1.1390 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -1.4880 1.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -0.7740 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -1.5750 -0.6020 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3430 -1.1980 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -3.0290 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -3.8950 -0.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -3.1930 -2.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -4.5120 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 -2.3340 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 -2.2460 2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 0.0920 2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 0.0060 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3850 -0.6030 3.9550 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4400 0.4870 4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8110 -1.1630 3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4930 -0.5670 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8590 -0.2320 1.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8330 -0.4950 2.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5580 0.0560 1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6810 -1.1500 5.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -1.6660 5.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4460 -0.9350 6.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -1.3960 7.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -1.1950 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -0.6610 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -2.3740 1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 0.3040 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -0.9880 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -4.7750 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 -5.2380 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -4.5190 -3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 -3.3650 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 -2.0080 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1480 -2.8310 2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -2.6190 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -0.2230 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 1.1170 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 0.3730 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 0.5940 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8170 -2.2540 3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3950 -0.9030 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2280 1.0810 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4310 -0.5700 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6180 0.0760 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5900 -1.1810 8.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 -2.4770 7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -0.8660 7.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -1.4340 0.7830 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6220 -1.7660 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5810 -0.8060 2.6170 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.2580 -0.4720 1.8860 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 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 51 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 51 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 53 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 14 53 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 16 53 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 51 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 51 1 M CHG 1 53 1 M END