IFLAB-ZINC02711131 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 0.0050 1.5020 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.0280 -0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0050 -0.4040 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.5270 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 0.1510 2.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -1.6680 1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -2.5530 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -3.5310 0.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -2.4090 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -0.6350 -1.5040 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -1.9950 2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -2.7930 3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -3.0630 2.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -3.2080 4.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -3.8690 5.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -4.7150 4.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -5.3660 5.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -5.1760 7.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -4.3330 7.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -3.6830 6.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -2.8650 7.3310 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -5.8140 7.8160 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 1.8740 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.8600 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.8620 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -2.8860 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.8760 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -2.5810 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -1.0740 3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -3.0480 4.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -4.8640 3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -6.0250 5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -4.1860 8.6590 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 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 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 26 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 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 30 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 M END