IBS-ZINC04954912 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 2.8730 1.8380 -3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 0.6170 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 0.3770 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -0.3800 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -1.5560 -2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 -2.3610 -3.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -3.6120 -3.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -3.7990 -4.3520 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5070 -3.1370 -4.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -5.2410 -4.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -5.8200 -3.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -4.7750 -2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -4.9480 -2.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -6.9760 -2.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -5.8640 -4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -7.1980 -4.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -5.0730 -5.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -5.4500 -6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -4.7060 -7.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 -3.5880 -7.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -3.2080 -5.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -3.9460 -5.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -3.5160 -5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -2.6800 -6.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -2.4210 -7.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -2.9970 -8.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -3.8320 -7.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -4.0880 -6.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -2.7200 -9.8030 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1000 -1.9850 -10.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -3.2270 -10.2730 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7300 2.3770 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 1.5120 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 2.4940 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 0.9420 -3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 0.0770 -4.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 0.3640 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 1.4090 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 0.1540 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -1.3810 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -0.4540 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -1.3810 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -2.1130 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -1.7800 -4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -2.5860 -3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -7.5430 -5.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -6.3220 -7.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -4.9960 -8.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -3.0080 -7.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 -2.3340 -5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -3.6510 -4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -2.2300 -6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -1.7690 -8.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 -4.2820 -8.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -4.7370 -5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -0.2680 -2.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 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 39 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 5 56 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 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 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END