NCID-ZINC05004774 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 -0.3150 2.5310 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 2.5210 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 2.9540 -1.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 2.0800 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 2.9950 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 1.9450 -2.5480 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6010 2.9060 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 2.7160 -2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8680 3.5950 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6790 4.6680 -3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 4.8590 -3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 3.9780 -3.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 5.9720 -4.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6720 6.6910 -4.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5220 5.6620 -3.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 0.5140 -2.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7610 0.2730 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 0.3930 -4.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -0.0080 -5.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 0.7710 -4.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -0.4420 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -0.0200 -2.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -1.7670 -2.7510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -2.6960 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -4.1060 -2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -4.6500 -4.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -5.9430 -4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -6.6930 -3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -6.1500 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -4.8580 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 1.7420 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 0.5740 0.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 2.7150 0.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3960 2.3720 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 3.6300 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1970 4.1050 1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7320 5.2590 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 5.9380 3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 5.4630 3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 4.3060 3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 1.5500 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 3.2840 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 2.7660 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 2.1730 -3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 1.8800 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8270 3.4440 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 4.1260 -4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 7.4100 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 7.1910 -5.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 1.8260 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1940 0.1680 -5.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4960 0.5920 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -2.1040 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -2.4550 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -2.6080 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -4.0640 -4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -6.3680 -5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -7.7040 -3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -6.7360 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.4350 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 3.6420 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 1.7130 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 1.8650 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7300 3.5740 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6820 5.6310 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 6.8400 3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 5.9940 4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 3.9330 3.7180 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 1 0 0 0 0 2 4 2 0 0 0 0 3 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 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 2 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