IFLAB-ZINC02709251 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.1690 1.4560 1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -0.0360 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -0.8870 1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -2.2560 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -2.7720 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -1.9210 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -0.5530 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -4.5160 0.1920 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -4.7220 -1.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -5.0720 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -5.0480 0.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -6.3100 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -7.2880 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -7.9060 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -8.8160 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -9.1160 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -8.5070 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -7.5990 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -6.7410 -0.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -5.9740 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -4.6350 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 -4.1660 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8300 -5.0210 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6080 -6.3390 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3000 -6.8400 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -8.0700 -0.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -8.0410 -0.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 1.8450 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 1.9250 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 1.6760 1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -0.4840 2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -2.9210 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -2.3250 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 0.1120 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -7.6710 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -9.2950 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -9.8290 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -8.7450 -2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -7.1280 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -3.9660 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -3.1250 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8400 -4.6390 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4390 -6.9940 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END