IBS-ZINC02586868 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 2.6970 2.6640 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 3.4420 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 4.2040 2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 4.3350 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 5.4160 2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 5.5340 3.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 6.0170 5.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6750 5.2670 5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 5.9570 5.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 6.4350 6.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 5.9190 7.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 6.7750 9.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 6.2810 10.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 5.0170 10.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 4.2060 9.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 4.6030 8.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 7.2960 6.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 5.4820 4.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 5.2680 4.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 5.1830 3.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 4.7130 2.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 7.3800 5.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 7.5610 6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 8.8080 6.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 9.8990 5.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 9.7330 4.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 8.4850 4.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 11.1850 5.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 11.3630 6.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 12.1120 4.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 13.3920 4.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 1.8290 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 3.5150 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 2.3350 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 4.3470 3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 2.6000 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 3.5910 4.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 3.9380 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 5.1270 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 3.3770 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 4.5920 4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 6.3900 2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 5.1810 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 7.7990 9.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 6.9050 11.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 3.1900 9.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 3.8890 7.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 4.9430 3.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 6.7340 6.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 8.9210 6.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 10.5650 3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 8.3840 3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 14.0530 4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 13.8210 5.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 13.3100 4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 3.0940 2.5140 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2890 2.2750 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 56 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END