IBS-ZINC02131329 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 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 0.0230 -0.6980 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.0820 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7640 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0760 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6840 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0830 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.9760 -2.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -4.2580 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -5.2470 -2.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.2240 -0.3640 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1580 -4.9590 0.2230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9990 -5.0020 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -6.3650 0.6020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1770 -7.1750 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -6.3470 0.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9800 -6.7800 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -7.1120 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -7.1880 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -6.6800 -0.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -7.8200 1.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -6.3830 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -7.3040 2.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -5.2230 2.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -4.3420 1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -3.2410 1.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -4.9310 3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -4.2750 4.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -3.9740 6.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -4.9160 6.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -4.6440 8.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -3.4260 8.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -2.4780 7.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -2.7540 6.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -1.2800 8.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -0.3550 7.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -3.1580 10.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -4.1780 10.9360 C 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 0.0260 -0.1620 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.6270 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2810 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5050 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0270 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -2.7100 -3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -6.5940 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -8.1200 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -8.2260 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 -7.8680 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -4.2530 4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -5.8580 4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -4.9520 4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -3.3480 4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -5.8660 6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -5.3820 9.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -2.0180 5.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -0.1160 6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 -0.8010 6.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 0.5560 7.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -5.0800 10.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -4.3960 10.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -3.8360 11.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -4.9020 0.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -4.7400 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 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 43 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 48 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 66 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 66 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 2 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 33 34 2 0 0 0 0 33 38 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 37 60 1 0 0 0 0 37 61 1 0 0 0 0 37 62 1 0 0 0 0 38 39 1 0 0 0 0 39 63 1 0 0 0 0 39 64 1 0 0 0 0 39 65 1 0 0 0 0 66 67 1 0 0 0 0 M END