PUBCHEM-ZINC04566340 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.1150 1.6030 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 0.0800 -0.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1870 -0.2670 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -0.6400 -1.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6310 -0.4010 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -2.1840 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.7820 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -2.3810 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -0.8540 -3.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.1930 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -0.6690 -2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -2.1980 -2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -0.0380 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -0.9670 3.5540 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4550 -0.5930 3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -1.1350 4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.5380 6.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -0.7030 7.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -1.4690 7.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -2.0620 5.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -1.8920 4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -1.6590 8.4010 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1730 -1.1770 9.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -2.2910 8.3230 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6720 -2.2310 2.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 1.9700 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 1.9550 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 2.0770 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -2.6200 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -2.4710 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -3.8740 -2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -2.7740 -3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -2.8210 -4.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -0.5100 -3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.5540 -4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 0.8930 -2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -0.2120 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -0.3470 -3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -2.6110 -3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -2.4840 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -0.2830 2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 1.0210 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 0.0550 6.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -0.2330 8.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -2.6620 5.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 -2.3700 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -2.9030 3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -0.3150 1.2000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6840 -1.3470 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 0.0730 1.2320 H 0 0 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 4 1 0 0 0 0 2 48 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 48 1 M END