IBS-ZINC05176897 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.1270 1.4900 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -0.0160 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -0.6950 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -2.0760 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -2.7830 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -2.1000 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -0.7180 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 0.0250 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -4.1840 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -4.8440 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -4.2380 2.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -6.3170 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -7.0600 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -8.4000 2.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -9.1610 3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -8.5380 4.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -9.2950 5.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -10.6790 5.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -11.3150 4.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -10.5630 3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -11.2360 1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -10.5810 0.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -6.9640 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -8.1760 -0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -6.1750 -1.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -4.8390 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -4.1860 -2.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 1.8490 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 1.8470 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 1.8650 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -0.1440 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -2.6040 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -2.6470 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 0.1990 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -0.5680 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 0.9800 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -6.5690 3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -8.8320 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -7.4600 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -8.8060 6.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -11.2620 6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -12.3940 4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -6.5850 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -12.5790 1.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -12.9760 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 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 33 1 0 0 0 0 7 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 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 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 44 45 1 0 0 0 0 M END