IBS-ZINC05354213 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -0.4080 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -1.9280 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -2.2690 2.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7420 -1.7630 2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -3.7590 3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -4.3870 3.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -1.8270 4.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -1.5480 5.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -1.6620 5.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -1.0930 6.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -0.8450 7.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -0.3840 8.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -0.1400 10.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -1.0080 10.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -0.4350 11.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -0.8690 12.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 0.8490 11.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 1.0880 10.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 2.3220 9.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 3.2910 10.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 3.0590 11.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 1.8510 11.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 0.0240 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.0010 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.3610 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -2.3350 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -1.7350 4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -0.1700 6.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -1.8630 6.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -1.7680 7.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -0.0750 7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 0.5390 8.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -1.1540 9.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -2.0110 11.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 2.5100 8.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 4.2450 9.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9120 3.8340 11.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 1.6790 12.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -4.3880 2.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -5.3440 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 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 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 44 45 1 0 0 0 0 M END