IBS-ZINC05050105 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.4650 1.1570 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 0.6660 3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 2.7130 1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 3.1690 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 4.6070 0.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 5.5240 -0.4070 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7100 5.2190 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 6.8680 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 6.6830 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 5.2220 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 4.7150 0.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 7.5150 0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 8.0310 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 9.1810 -0.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 8.1750 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 7.8300 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 7.9830 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 8.4800 -2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 8.8290 -1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 8.6780 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 9.3250 -0.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 9.5260 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 5.4670 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 6.0000 1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 5.9000 2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 5.2600 1.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 4.7190 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 4.8270 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 4.0520 0.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 4.0320 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 0.1000 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 1.7470 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 1.5180 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 1.2400 3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -0.3720 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 0.6930 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 3.3310 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 2.7550 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 2.8980 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 2.6750 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 9.9040 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 7.4520 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 7.7200 -4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 8.5880 -3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 8.9590 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 8.5780 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 10.2560 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 9.9310 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 6.5000 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 6.3240 3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 5.2020 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 4.4050 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 5.0470 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 3.4660 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 3.5220 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 1.2800 1.7050 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5300 0.7260 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 56 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 41 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 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 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 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END