IFLAB-ZINC05258133 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 0.0050 1.5030 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -0.6910 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.0720 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.7710 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -2.0780 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -0.6960 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 0.0570 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.2510 2.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -6.3490 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -6.8660 2.5550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4080 -6.5120 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -8.3730 2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -8.9730 2.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -6.3170 4.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -5.7980 5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 1.8770 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8590 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 1.8630 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -0.1480 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -2.6080 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -2.6180 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 0.2490 -2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -0.5380 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 1.0040 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.6510 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -6.7880 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -6.6280 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -7.3160 5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -5.6480 4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -6.4670 4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -4.7990 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -5.4040 7.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -9.0490 2.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -6.3710 3.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -6.9340 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -5.7440 6.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -5.1810 6.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -10.0150 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 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 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 37 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 39 1 0 0 0 0 35 39 1 0 0 0 0 36 41 1 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 M END