PUBCHEM-ZINC05702898 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9920 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -2.6040 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.8360 -3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.4520 -3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.1610 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -2.4390 -4.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -1.5860 -5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 -2.4390 -6.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8900 -3.1390 -6.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 -1.5310 -7.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 -2.3540 -8.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -2.8280 -9.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -2.7140 -10.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -3.3210 -11.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -4.0460 -12.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -4.1710 -11.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -3.5610 -10.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 -3.5030 -9.8790 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8940 -2.7890 -8.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9430 -2.5210 -7.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1990 -4.1370 -10.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9250 -3.1790 -11.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1780 -2.8750 -11.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 -3.1650 -5.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.5900 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -3.6820 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 0.1470 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 1.2390 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -0.9660 -5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 -0.9480 -4.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -0.9130 -7.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 -0.8910 -7.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -2.1510 -9.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -3.2310 -11.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 -4.5170 -12.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 -4.7370 -12.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 -1.9840 -7.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8280 -2.8690 -8.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 -4.4010 -9.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9380 -5.0380 -10.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4130 -2.7430 -12.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6900 -3.3110 -10.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6980 -2.1880 -11.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4360 -2.6040 -5.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 M CHG 1 21 1 M END