IBS-ZINC04043100 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1590 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2950 -2.5070 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -2.6840 -0.6020 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2910 -2.2890 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -4.2100 -0.5170 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6000 -4.6020 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -4.6180 0.9530 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1090 -4.2030 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -6.1450 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 -6.6000 0.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 -6.1870 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -4.7590 -1.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -6.7890 -1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0630 -6.6800 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -4.1050 1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -2.6740 1.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7910 -2.2680 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -2.2500 1.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -2.5360 3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -2.1540 3.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -2.4450 5.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -3.1160 5.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -3.4980 5.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -3.2040 4.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -3.4320 7.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -2.1310 8.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -4.1730 7.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -4.3140 7.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -2.2750 -1.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.2200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -6.5630 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -6.4560 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -7.8760 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -6.4740 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -6.4440 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8590 -6.2580 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -6.3650 -2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0990 -7.7680 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -1.6300 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 -2.1480 5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -4.0230 5.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -3.4980 3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -1.5040 8.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -2.3600 9.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 -1.6040 7.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -5.1000 7.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -4.4020 9.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -3.5450 7.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -3.7860 7.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -4.5420 8.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -5.2410 6.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -1.3160 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 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 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 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 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 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 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 M END