PUBCHEM-ZINC05138299 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 53 0 0 1 0 0 0 0 0999 V2000 -2.0830 1.8470 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 0.4740 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 0.5560 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -0.5830 0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -2.0460 0.3060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0930 -2.1100 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -2.9160 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -2.7440 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -2.0880 0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -3.4090 1.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 -3.2880 1.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -2.6240 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -3.2490 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -2.3580 -0.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -1.8230 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -2.8290 -1.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9740 -3.9160 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 -2.1760 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 -0.7590 -0.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 -0.5940 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -2.5290 -2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 -1.7780 -3.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2920 -3.1780 -3.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9030 -3.7760 -2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7380 -3.0760 -4.6580 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4480 -2.0880 -5.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -4.1990 -5.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5440 -4.0860 -7.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 -4.2090 -5.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2940 -3.2230 -4.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7590 -3.9810 -3.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 2.6070 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 1.8230 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 2.1640 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 0.2320 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -0.3620 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 1.3750 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 0.7310 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -0.3050 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -0.5170 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -2.6960 2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -3.9800 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -3.9710 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -2.7080 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0350 -2.3950 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 -2.5410 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4650 -5.1730 -5.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3050 -3.0980 -7.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 -4.8360 -7.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6170 -4.2600 -7.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 -4.4500 -4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -4.9710 -6.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 -3.2410 -5.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8910 -2.5610 -5.5940 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 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 10 43 1 0 0 0 0 11 44 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 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 2 0 0 0 0 30 54 1 0 0 0 0 M CHG 1 54 -1 M END