IFLAB-ZINC04540128 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.3700 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.0080 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -0.6800 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -2.0870 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -2.6890 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -1.9130 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -0.6030 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 0.0480 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4600 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 2.0980 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 2.2020 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 3.4540 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 3.8990 1.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 4.3010 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 5.6460 1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 6.0240 1.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 7.2150 2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 7.5980 2.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 8.0580 1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 6.9300 1.1110 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 1.8920 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -0.5420 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -2.6730 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -3.7670 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -2.4020 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 3.1770 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 1.8180 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 3.8060 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 4.4350 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 8.9540 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 8.3180 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 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 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 M END