ANALYTICONDISCOVERY-ZINC04221857 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 74 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.6060 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 0.1570 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 -0.4660 -3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8580 -3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.6190 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -2.0070 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.8280 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -2.2940 0.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -4.1730 -0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -4.9910 0.9370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3440 -4.5030 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -6.3680 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -7.2220 1.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4100 -7.3830 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -6.0060 3.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9430 -5.5180 3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -5.1520 2.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4640 -5.6390 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -3.8650 2.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -6.1560 4.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -8.5790 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -9.0140 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -9.3080 1.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 -10.6270 0.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0070 -10.6170 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5440 -10.9660 1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 -10.0010 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -8.8730 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 -8.2560 0.3230 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 -7.4240 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8450 -8.9900 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -10.1130 -0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 -11.0430 -1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -10.8560 -2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3320 -9.7490 -3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5030 -8.8220 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -11.6640 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -11.3340 2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -12.9590 1.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -6.5830 1.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 0.5060 -4.4250 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -0.7430 -5.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 1.2350 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -2.3350 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -3.6970 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.5990 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -6.2530 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -6.8560 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -7.9920 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -7.8710 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -3.8910 3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -6.6880 4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -8.9600 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -11.9820 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -10.8900 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7750 -8.5070 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 -11.9070 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3980 -11.5760 -3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8420 -9.6150 -4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1380 -7.9630 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 -13.2230 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -13.6260 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -7.0700 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 -1.3570 -5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -1.3740 -5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 -0.2480 -6.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 50 1 0 0 0 0 8 9 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 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 56 1 0 0 0 0 22 57 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 58 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 39 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 61 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 38 2 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 35 62 1 0 0 0 0 36 37 2 0 0 0 0 36 63 1 0 0 0 0 37 38 1 0 0 0 0 37 64 1 0 0 0 0 38 65 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 41 66 1 0 0 0 0 41 67 1 0 0 0 0 42 68 1 0 0 0 0 43 44 1 0 0 0 0 44 69 1 0 0 0 0 44 70 1 0 0 0 0 44 71 1 0 0 0 0 M END