IBS-ZINC05450788 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.5210 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.0030 0.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3220 -0.4060 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -0.4520 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -1.0420 -1.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -0.5150 -0.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -0.5000 -0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -0.0630 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -1.0810 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 -1.0600 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 -1.5490 -3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 -2.8300 -3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -2.8690 -4.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 -3.6870 -5.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 -1.6330 -5.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 -0.7820 -4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 0.5610 -4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 1.0020 -6.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 0.1280 -7.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 -1.2080 -6.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 1.9030 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 1.9440 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 1.9070 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -0.9170 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -2.1090 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -0.4990 -3.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 -0.0430 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -1.6780 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 -3.7170 -3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 1.2490 -4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 2.0360 -6.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2110 0.4890 -8.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6370 -1.8870 -7.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -0.1900 0.7660 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 6 7 1 0 0 0 0 6 24 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 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 15 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 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 M CHG 1 34 -1 M END