PUBCHEM-ZINC04215026 MOE2007 3D CORINA 3.40 0006 02.08.2006 102106 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5050 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6460 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.0270 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -2.7380 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -4.1380 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -4.7980 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -4.0960 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -2.7350 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -2.0140 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.6700 -1.1280 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0270 0.0510 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 0.5060 -2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 1.9370 -3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 2.7570 -2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 4.1890 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 5.1410 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 6.5640 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 7.5190 -2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 8.4710 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 8.4290 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 8.4710 1.0820 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8470 7.4110 1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 7.4120 3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 8.5330 3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 9.6350 3.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 9.5760 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 10.6970 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 11.7820 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 11.8220 3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9290 10.7660 3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 8.5750 5.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 7.4790 5.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 6.2390 5.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 5.0280 5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 4.1710 6.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 2.6890 6.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 2.2150 5.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 0.7170 5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 0.2290 4.2810 C 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 3.2970 5.3600 4.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 4.4320 4.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 4.3840 7.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 4.4010 6.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 2.5510 5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 2.1080 7.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 2.3980 5.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 2.7640 4.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 0.5420 4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 0.1710 5.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 0.3040 4.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 0.8460 3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -1.2660 2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -1.7420 4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.5900 4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -1.1670 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -3.6650 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 5.5120 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 5.5730 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 6.3310 -0.0380 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 11 2 0 0 0 0 3 4 2 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 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 2 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 52 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 53 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 55 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 57 1 0 0 0 0 14 58 1 0 0 0 0 15 16 1 0 0 0 0 15 59 1 0 0 0 0 15 60 1 0 0 0 0 16 17 1 0 0 0 0 16 61 1 0 0 0 0 16 62 1 0 0 0 0 17 18 1 0 0 0 0 17 63 1 0 0 0 0 17 64 1 0 0 0 0 18 19 1 0 0 0 0 18 65 1 0 0 0 0 18 66 1 0 0 0 0 19 20 1 0 0 0 0 19 67 1 0 0 0 0 19 68 1 0 0 0 0 20 21 1 0 0 0 0 20 69 1 0 0 0 0 20 70 1 0 0 0 0 21 22 1 0 0 0 0 21 71 1 0 0 0 0 21 72 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 73 1 0 0 0 0 25 26 1 0 0 0 0 25 32 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 74 1 0 0 0 0 29 30 2 0 0 0 0 29 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