PUBCHEM-ZINC06303441 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.3210 1.6590 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 0.3610 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.2150 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 1.1810 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 0.4770 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -0.8310 2.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -0.9880 1.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 0.9740 3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 0.9370 4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 0.7310 6.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 -0.7110 6.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -1.2470 7.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -0.8570 7.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 -2.4040 8.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2960 -2.2030 8.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 -2.0860 6.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -0.9550 6.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -0.3630 5.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 1.7890 6.6210 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 1.7300 7.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8890 2.3500 7.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9170 2.2130 8.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7120 1.2970 9.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 2.5540 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 3.4410 2.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 2.8510 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.9020 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 1.4920 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -0.4950 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 0.4200 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 0.3700 3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 1.9980 3.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 1.8720 5.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 0.1280 4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 -2.4740 9.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -3.3250 7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5570 -1.3040 8.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 -3.0500 8.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8960 -1.9020 6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 -3.0120 6.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -1.3390 5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 2.3030 8.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6690 0.7200 8.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 1.8760 6.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7520 3.4120 7.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 3.1280 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 3.7120 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8750 3.0370 8.4860 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 24 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 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 48 -1 M END