NCID-ZINC04715212 MOE2007 3D CORINA 3.40 0006 02.08.2006 78 81 0 0 1 0 0 0 0 0999 V2000 -0.0800 1.9400 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 0.4310 -0.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5810 0.1390 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 0.0070 2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -0.2480 3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -0.3710 3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -0.2460 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 0.0060 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 0.1080 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 0.2110 0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 0.0840 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 0.3640 -2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.3560 -3.6730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9010 -0.4240 -3.6800 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1070 -1.4800 -3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.1110 -2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.2760 -1.2220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5450 -1.3540 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.2580 -5.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0710 0.7990 -5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -0.8360 -6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -0.3250 -6.1310 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1390 -0.2550 -4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 -0.6580 -4.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 1.0450 -6.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 1.9910 -6.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 1.2190 -8.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 2.5510 -8.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 2.3790 -10.8280 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2190 2.6970 -11.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 3.1040 -11.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 4.6150 -11.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2580 5.4760 -12.6160 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0500 5.1360 -13.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 7.2240 -12.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 0.8910 -11.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 0.1750 -10.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -1.6850 -6.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -0.7440 -6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -2.4210 -4.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 1.7040 -4.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 0.6690 -2.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 -0.3640 2.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -0.0320 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 2.2960 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 2.1530 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 2.4460 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 0.1020 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.3510 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -0.5640 4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 1.1960 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -0.3290 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 0.4630 -8.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 2.6710 -9.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 3.3090 -7.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 2.8550 -11.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 2.7950 -12.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 4.8650 -11.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 4.9250 -10.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 7.4680 -11.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5300 7.8460 -12.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 7.4090 -12.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -1.0090 -6.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -1.0840 -7.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 0.3220 -6.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -1.2930 -6.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -2.5740 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -2.8210 -5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -2.9340 -4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 2.2680 -4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 1.5660 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -1.2680 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 0.3770 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 2.7030 -9.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 3.6330 -9.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 0.3620 -12.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.9840 -5.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -0.5970 -12.3320 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 2 17 1 0 0 0 0 2 44 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 49 1 0 0 0 0 6 7 2 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 43 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 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 77 1 0 0 0 0 21 22 1 0 0 0 0 21 38 2 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 63 1 0 0 0 0 23 24 2 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 74 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 36 1 0 0 0 0 29 74 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 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 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 36 37 2 0 0 0 0 36 76 1 0 0 0 0 39 64 1 0 0 0 0 39 65 1 0 0 0 0 39 66 1 0 0 0 0 39 77 1 0 0 0 0 40 67 1 0 0 0 0 40 68 1 0 0 0 0 40 69 1 0 0 0 0 40 77 1 0 0 0 0 41 70 1 0 0 0 0 42 71 1 0 0 0 0 43 72 1 0 0 0 0 44 73 1 0 0 0 0 74 75 1 0 0 0 0 76 78 1 0 0 0 0 M END