PUBCHEM-ZINC06627874 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -2.6030 0.6010 2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -0.7550 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -1.8250 3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -3.0650 2.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -3.2040 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -2.1750 0.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -0.9820 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -4.5360 0.9730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3060 -5.3370 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -4.7380 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -5.8400 2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -6.0350 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -5.1390 2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -4.0380 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -3.8390 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 -5.4510 2.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 -4.5880 2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 -5.1450 2.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5820 -6.3340 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7570 -6.8600 2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3960 -6.2060 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8580 -5.0270 4.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6830 -4.4990 3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -5.9180 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -6.2640 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -5.9350 -1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -4.6150 -1.0560 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9800 -4.5070 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -3.4330 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -2.7890 -2.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 1.1990 3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 1.1240 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 0.5280 3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -1.6970 4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -3.8940 3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -0.1860 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -6.5620 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -6.8960 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -3.3100 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -2.9630 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -4.5420 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 -3.5760 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0870 -6.8580 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1720 -7.7820 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3100 -6.6160 4.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3540 -4.5190 5.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2780 -3.5810 4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -6.7150 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -5.6800 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -5.6420 -3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -7.3120 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -5.8810 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -6.7100 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -4.6870 -0.5450 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3970 -3.8410 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -3.1660 -2.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -2.3960 -2.9130 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 54 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 54 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 54 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 54 1 M END