IBS-ZINC05477643 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 70 0 0 1 0 0 0 0 0999 V2000 0.3020 2.3070 -0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 0.7950 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 0.4980 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 0.2520 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -1.2740 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -1.8160 -0.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8520 -1.3370 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -3.3280 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -3.6200 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -5.3900 2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -6.8850 3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -7.6160 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -8.9870 2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -9.6320 3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -8.8960 3.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -7.5210 3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -9.5240 4.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 -8.7050 5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -10.9810 3.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -11.6720 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -1.5230 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -0.7480 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -0.4780 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -0.9860 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 -1.7630 -3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 -2.0250 -2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 -0.7220 -4.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 -0.0160 -4.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5220 1.4880 -4.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7800 -0.3360 -5.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 2.6930 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 2.5190 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 2.7860 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 0.3160 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 0.8840 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 0.9760 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -0.5800 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 0.6640 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 0.5410 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -1.6850 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -1.5620 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -3.7280 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -3.7980 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -3.2200 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -3.1500 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -4.9320 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -5.0020 2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -7.1150 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -9.5560 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -6.9470 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -7.9730 5.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -8.1880 4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -9.3300 5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -11.5090 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -11.2940 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -12.7380 3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 -0.3540 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0640 0.1270 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -2.1590 -4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -2.6260 -2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2300 -0.3230 -3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 1.7160 -3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0910 1.7950 -5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4560 2.0260 -4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9770 -1.4070 -5.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7130 0.2030 -5.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3490 -0.0290 -6.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -5.0720 1.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -5.4760 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 9 68 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 10 68 1 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 48 1 0 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 68 69 1 0 0 0 0 M END