IFLAB-ZINC00088597 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8240 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.1240 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1100 -0.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.8880 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7690 -1.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.1960 1.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -2.9330 2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -3.8150 3.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -1.5830 3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.4570 2.5820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0790 -0.3420 2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 0.8320 2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 1.9290 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 3.1120 3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 3.1980 3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 2.1020 2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 0.9200 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 4.4640 3.3940 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2450 5.4310 3.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 4.5400 3.0930 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -4.1030 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -1.5040 3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -1.4780 4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 1.8620 3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 3.9690 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 2.1690 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 0.0640 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END