IBS-ZINC02726703 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0530 1.2690 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.2590 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.7030 -1.3040 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6760 -0.2580 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -2.2280 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -0.2650 -2.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.0770 -3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -0.2700 -3.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 0.3650 -4.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 0.5570 -6.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 0.9730 -7.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 1.2740 -8.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 1.2500 -9.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 1.5950 -10.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 1.9650 -11.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 1.9930 -10.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 1.6480 -9.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 1.5870 -8.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 1.7980 -8.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 1.1850 -7.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 0.9680 -5.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 0.5680 -4.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 1.1840 -5.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 2.3470 -6.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 2.5420 -5.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4550 1.5830 -5.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8650 0.4290 -4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 0.2190 -4.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -0.9200 -4.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -1.8610 -3.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2790 3.6770 -6.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6850 3.8140 -6.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 1.6400 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 1.6700 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 1.5850 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -0.6600 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -0.6310 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.5440 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -2.5540 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -2.6730 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.1110 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 0.3870 -6.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 0.9630 -8.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 1.5780 -11.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 2.2340 -12.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 2.2820 -10.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 3.0940 -6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5150 1.7410 -5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 -0.3130 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -2.7220 -3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 -1.3910 -2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5590 -2.1880 -4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2090 2.9920 -6.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8920 3.7950 -5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0260 4.7610 -6.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 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 22 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 20 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 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END