IFLAB-ZINC04941892 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8270 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1400 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -3.2020 1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.9120 2.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -1.6600 3.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.6360 2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.5150 1.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -5.6060 2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -6.9480 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -8.0700 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -8.6000 2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -9.6290 3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -10.1330 4.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -9.6000 3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -8.5720 2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -10.0910 4.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7370 -9.4960 3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -11.1460 5.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -11.6430 5.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0670 -0.7510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.8360 -1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -1.4710 4.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -4.7140 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -5.5220 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -5.5450 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -7.0320 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -7.0090 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -8.2080 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -10.0410 4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -8.1600 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -9.6220 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 -8.4340 3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -9.9790 4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -10.8370 6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -12.0250 4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -12.4460 6.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 23 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 22 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 M END