IBS-ZINC05180203 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.6050 2.0720 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 0.7080 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -0.1470 1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -1.2990 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -1.1650 0.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 -1.8550 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 0.0310 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 0.4130 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 1.4430 -2.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -0.5710 -2.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -0.3080 -3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -2.5630 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 0.1750 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 1.0110 2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -0.4630 4.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8420 -0.2990 5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 0.0260 6.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 0.1160 7.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 0.1800 6.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 0.1030 4.9080 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2950 -0.6490 4.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 1.4330 4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 2.6110 4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 3.8210 4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 3.8720 3.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9270 2.7130 3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 1.5020 3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 0.4180 7.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 1.8750 7.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 3.3850 9.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 1.8510 9.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -0.4860 4.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 1.9970 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 2.6730 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 2.6250 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -0.2180 -4.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -1.1540 -3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 0.5970 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -2.3740 3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -3.2950 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -3.0240 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 2.6030 4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 4.7220 4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 4.8130 3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9530 2.7520 3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 0.6110 3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 0.1110 7.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -0.2380 8.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 2.1890 8.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 2.5600 7.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 4.1740 9.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 3.4430 9.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 3.4380 10.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3330 0.8220 8.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5340 2.5650 8.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 2.0180 10.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -1.5470 4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 2.0490 9.2260 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3000 1.3380 9.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 57 1 0 0 0 0 16 17 1 0 0 0 0 16 32 2 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 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 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 58 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 58 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 58 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END