IFLAB-ZINC04139520 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.7540 -1.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7800 -4.6160 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -3.4770 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -5.9220 -1.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7890 -6.8110 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -6.1910 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -7.1580 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -7.2120 1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6030 -6.2900 1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 -5.2730 0.4950 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 -6.6830 -2.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2610 -6.2650 -3.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5600 -5.8950 -4.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -4.8240 -4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -5.2280 -3.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -3.2620 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -3.6150 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -2.6460 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -7.8460 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 -7.9470 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3400 -6.1820 2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -6.9110 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 -7.5660 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9290 -7.0980 -3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8420 -5.4150 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -4.6170 -5.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1640 -3.9330 -4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 -6.0870 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -4.3940 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3040 -5.5820 -2.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 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 32 1 0 0 0 0 7 33 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 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 49 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 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M END