IBS-ZINC02297829 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.4700 0.5670 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 0.3130 0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -0.2680 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -0.5330 2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -1.1390 3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -1.4780 2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -1.2110 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -0.6080 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -2.1440 3.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 -1.6450 4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -2.5030 5.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4200 -2.1850 5.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -3.6610 6.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -4.6700 6.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -5.9240 7.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -5.8790 6.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -0.3810 5.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 0.1510 6.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -0.4600 7.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 1.5910 6.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 2.0420 8.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 3.3900 8.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 4.2890 7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 3.8460 6.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 2.4990 5.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -0.3630 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 1.0140 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 1.2840 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -0.2760 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -1.3550 4.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 -1.4760 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.4230 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -3.1210 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -3.8980 6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 -4.9490 6.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 -4.2110 7.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 0.1930 4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 1.3450 8.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 3.7390 9.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 5.3390 7.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 4.5540 5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 2.1860 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -6.8330 7.8850 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 43 -1 M END