PUBCHEM-ZINC06043109 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 1.3040 -1.8300 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -1.5440 -1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -2.4700 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -2.1830 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 -2.9460 0.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4420 -2.6790 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -2.5310 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -1.0650 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -4.4740 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8530 -5.2160 0.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -5.4680 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 -5.1140 -2.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9140 -6.1840 -0.7520 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4640 -5.5680 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7250 -6.1970 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0620 -6.9100 -1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8600 -8.3330 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 -8.3550 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7450 -7.6130 -0.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0650 -8.1730 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -7.7030 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 -6.5870 1.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -1.1570 -2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -2.8590 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -1.6830 -3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -1.6710 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -0.4990 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -2.3370 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -3.5080 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -2.4190 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -1.1050 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 -3.1270 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -2.7530 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -0.4030 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -0.7890 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 -0.8800 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -4.7840 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -4.7900 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -5.6160 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9030 -5.1680 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 -6.6880 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6990 -6.3580 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5830 -6.9250 -2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8340 -8.8180 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3140 -8.9140 -2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7160 -7.9070 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9390 -9.4030 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 -8.8690 1.6890 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 M CHG 1 48 -1 M END