CHEMDIV-ZINC04793573 MOE2007 3D CORINA 3.40 0006 02.08.2006 79 84 0 0 1 0 0 0 0 0999 V2000 -0.4910 0.5700 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -0.7800 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -1.7060 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -2.9470 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -3.2730 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -2.3580 -1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -1.1070 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -2.7190 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -3.0110 -4.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -3.1280 -4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -4.3630 -4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -4.3920 -2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -4.2630 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8910 -4.3650 -4.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 -5.5760 -3.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9140 -5.6860 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8040 -4.7730 -1.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5420 -7.0180 -2.1330 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7800 -6.9140 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5820 -8.1750 -2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 -8.3710 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -9.4310 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -10.3010 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7470 -10.1110 -3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 -9.0540 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6670 -8.8570 -4.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5620 -9.5010 -5.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6620 -7.9090 -4.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8560 -7.2480 -2.9000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.3080 -6.2700 -3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8540 -8.0230 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1250 -9.3800 -2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0880 -9.6470 -1.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4570 -8.4910 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7000 -7.4550 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8780 -6.1460 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8010 -5.9150 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5440 -6.9630 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3860 -8.2690 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6350 -10.9600 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6050 -7.5870 -5.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 1.2760 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 0.9540 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 0.5160 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -1.4650 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 -3.6610 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -4.2480 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.3730 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -1.8800 -3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -3.6010 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -3.8520 -5.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -2.0710 -5.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 -2.2200 -4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 -3.1680 -6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -5.2620 -4.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -3.5800 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -5.3320 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -4.1950 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -5.1070 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-2.3970 -2.2180 -2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 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 45 1 0 0 0 0 4 5 1 0 0 0 0 4 46 1 0 0 0 0 5 6 2 0 0 0 0 5 47 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 48 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 8 78 1 0 0 0 0 9 10 1 0 0 0 0 9 51 1 0 0 0 0 9 52 1 0 0 0 0 9 78 1 0 0 0 0 10 11 1 0 0 0 0 10 53 1 0 0 0 0 10 54 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 55 1 0 0 0 0 12 13 1 0 0 0 0 12 56 1 0 0 0 0 12 57 1 0 0 0 0 13 58 1 0 0 0 0 13 59 1 0 0 0 0 13 78 1 0 0 0 0 14 15 1 0 0 0 0 14 60 1 0 0 0 0 14 61 1 0 0 0 0 15 16 1 0 0 0 0 15 62 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 22 64 1 0 0 0 0 23 24 2 0 0 0 0 23 65 1 0 0 0 0 24 25 1 0 0 0 0 24 66 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 41 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 32 67 1 0 0 0 0 33 34 1 0 0 0 0 33 40 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 36 68 1 0 0 0 0 37 38 2 0 0 0 0 37 69 1 0 0 0 0 38 39 1 0 0 0 0 38 70 1 0 0 0 0 39 71 1 0 0 0 0 40 72 1 0 0 0 0 40 73 1 0 0 0 0 40 74 1 0 0 0 0 41 75 1 0 0 0 0 41 76 1 0 0 0 0 41 77 1 0 0 0 0 78 79 1 0 0 0 0 M CHG 1 78 1 M END