IFLAB-ZINC04269946 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 2.0510 1.3880 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 0.1060 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -1.0070 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -0.7690 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 0.4670 0.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 1.5150 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -2.3550 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -2.4300 0.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -3.5980 0.6340 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5970 -3.2900 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -4.4550 -0.6480 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3150 -3.8000 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -5.3350 -0.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -5.6840 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -6.3990 0.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -5.2080 1.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -4.4130 1.8660 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9960 -3.5180 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -2.6120 3.0160 F 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -4.2620 4.2280 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -2.8280 3.3710 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 -5.3810 2.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -5.1800 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -6.5240 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -7.1030 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3440 -6.3600 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 -5.0350 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -4.4540 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -6.9630 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8400 -8.1770 -0.8510 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4320 2.2610 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -0.0180 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -1.5590 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 2.4920 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -5.7370 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -5.4640 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -6.2380 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -7.1280 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -8.1380 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 -4.4450 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 -3.4170 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6740 -6.2130 -1.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 40 1 0 0 0 0 28 41 1 0 0 0 0 29 30 1 0 0 0 0 29 42 2 0 0 0 0 M CHG 1 30 -1 M END