IFLAB-ZINC05146778 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 4.9800 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 5.3940 -1.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 6.7010 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 7.5350 -0.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 7.1270 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 8.6280 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 9.3670 -3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 11.0460 -2.8090 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 10.6160 -1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 9.2570 -1.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 8.9190 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5310 10.0740 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 11.0980 -0.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6250 10.1910 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1170 11.4470 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1340 11.5530 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6680 10.4110 2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1810 9.1590 2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1670 9.0460 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6700 10.5180 3.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1730 9.3020 4.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 5.3120 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 5.4260 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 4.7270 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 6.7940 -3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 6.6800 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 9.0200 -3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2280 7.9220 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7010 12.3360 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5150 12.5260 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5980 8.2720 2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7910 8.0710 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5690 8.6740 3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3670 8.7760 4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9670 9.5300 4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 50 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 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 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 M END