IFLAB-ZINC00646715 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1410 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -0.4790 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -1.8560 3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.6270 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.0010 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -4.1030 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -4.7720 1.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -4.7050 3.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -6.0870 3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -6.8840 2.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -8.2100 2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -9.2760 1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -10.5760 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -10.8630 3.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -9.8390 4.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -8.5130 3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -7.0020 4.6090 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -12.5380 3.8370 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -12.5400 5.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -13.3140 3.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -12.9820 3.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2390 -12.8420 3.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2860 -13.3610 2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 -13.2390 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 -13.5900 1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.2190 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1170 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -2.3360 4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -2.5920 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -4.1710 3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -9.0680 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -11.3830 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 -10.0640 5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -11.7930 4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 -13.4340 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1780 -12.7340 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 -14.4000 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 -12.2240 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 -13.9600 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 -14.6700 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -13.1570 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 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 36 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 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 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M END