SPECS-ZINC04657020 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 67 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 0.0320 -1.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6810 -0.3290 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 1.5620 -1.2590 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6060 1.9230 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 2.0840 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 1.3080 -1.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 3.4120 -1.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 3.9190 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 5.4490 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 5.9780 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 7.5080 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9790 8.0380 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9580 9.5680 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3320 10.0750 -1.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5600 11.4030 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6280 12.1780 -1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9740 11.9250 -1.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4840 11.5730 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7140 11.4180 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9980 11.9110 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9770 13.4410 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2370 13.9480 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9540 13.4540 -1.2800 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9760 13.8320 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2250 13.9540 -2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 13.1670 -3.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -0.4540 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 0.3420 -3.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 3.1450 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.6940 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 4.0320 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 3.5580 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 3.5670 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 5.8100 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 5.8000 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 5.6170 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0740 5.6270 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 7.8690 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0330 7.8600 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5060 7.6770 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4890 7.6860 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 9.9290 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4480 9.9190 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0780 9.4540 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7290 10.3280 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7370 11.7950 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9760 11.5340 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5250 11.5500 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4670 13.7920 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 13.8180 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2150 13.5700 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2230 15.0380 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0820 15.2730 -2.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -1.7710 -2.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 -2.0340 -3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6070 15.5450 -3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 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 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 63 1 0 0 0 0 31 32 2 0 0 0 0 31 64 1 0 0 0 0 63 66 1 0 0 0 0 64 65 1 0 0 0 0 M END