PUBCHEM-ZINC02545934 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 -0.6930 1.6200 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 0.2740 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 0.4110 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -0.6890 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.3610 -1.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 0.2180 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 1.2850 -0.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -0.5920 -1.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 -0.2960 -2.3250 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4620 0.6480 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -0.1380 -3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 0.9740 -4.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 0.9100 -6.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 2.0060 -6.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 3.3900 -6.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 3.4720 -4.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 2.3750 -3.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -1.4060 -1.7930 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8380 -2.3660 -2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0530 -1.5390 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 -2.6480 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0690 -2.7240 -0.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4570 -1.1130 -2.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -1.7740 -1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 2.3690 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 1.5160 -2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 2.0240 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 0.7380 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -0.5440 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 1.1380 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -0.8420 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -1.6770 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -0.3160 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -1.4460 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3510 0.0560 -4.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 -1.0940 -4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 0.7930 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 1.0030 -6.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 -0.0670 -6.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 1.9590 -7.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 1.8330 -6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 3.6200 -6.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 4.1470 -6.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 4.4540 -4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 3.3850 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 2.4560 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 2.5510 -4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 -0.6110 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 -1.7700 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 -3.3290 1.1670 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 50 -1 M END