NCID-ZINC05004774 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 -0.8990 3.3810 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 1.9380 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 1.2850 -1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 1.3510 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8960 1.3370 -3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 0.3440 -0.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8360 1.0200 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 1.5310 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 2.1520 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 2.2640 3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 1.7500 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 1.1340 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2490 1.9840 3.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 3.0040 4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 2.8200 4.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -0.7810 -0.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7250 -0.3670 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -1.7950 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 -2.7750 0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -1.5870 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -1.4460 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -1.0590 -2.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -2.4720 -1.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -3.1190 -2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -4.2280 -2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -5.5080 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -6.5240 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -6.2610 -2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -4.9810 -3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -3.9650 -3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 1.6910 -2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 1.0650 -2.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 2.6620 -3.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 3.1080 -4.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 4.1770 -5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 3.8290 -6.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 4.8100 -6.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 6.1400 -6.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 6.4880 -5.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 5.5070 -4.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 3.5140 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 3.6600 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 4.0120 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -0.0710 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 1.4440 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 2.5500 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9510 0.7380 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0610 3.9950 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 2.8540 5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -0.6560 2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -1.5360 2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -2.4190 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -2.7820 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -3.5330 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -2.3860 -3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -5.7140 -2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -7.5240 -2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 -7.0550 -2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7750 -3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -2.9660 -3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 3.0570 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 2.2630 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 3.5100 -3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 2.7900 -6.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 4.5380 -7.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 6.9060 -7.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 7.5270 -5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 5.7800 -3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 6 1 0 0 0 0 4 31 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 37 65 1 0 0 0 0 38 39 2 0 0 0 0 38 66 1 0 0 0 0 39 40 1 0 0 0 0 39 67 1 0 0 0 0 40 68 1 0 0 0 0 M END