PUBCHEM-ZINC03870441 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 79 0 0 1 0 0 0 0 0999 V2000 1.9960 2.3930 1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 1.8240 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 2.1170 2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 1.6150 2.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 2.9510 1.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 3.1450 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 3.5320 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 3.2640 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.8490 -0.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7460 3.0980 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 5.0720 -0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 4.6890 -1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 4.4730 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 4.2300 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 4.7710 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 4.7540 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 5.2950 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0810 5.2790 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1320 5.8200 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5060 5.8040 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5570 6.3450 2.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9300 6.3280 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9810 6.8700 2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3310 7.3990 2.5520 C 0 0 3 0 0 0 0 0 0 0 0 0 -14.0890 7.1360 3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3630 8.9190 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5870 9.4440 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8410 9.0060 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8030 7.5270 2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6660 6.8030 2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7020 5.4260 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8820 4.8320 1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0500 5.6130 1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.1200 5.1020 1.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.9850 6.9240 1.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 -18.7960 7.4550 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 2.1750 1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 1.1580 3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 5.3810 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 5.8880 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 3.7700 -2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 5.4930 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 5.4310 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 4.0510 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 3.2070 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 4.8540 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 4.1460 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 5.7930 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 5.3790 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 3.7320 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 4.6700 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 6.3180 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 5.9040 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 4.2570 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1580 5.1950 2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8770 6.8420 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4800 6.4280 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7610 4.7810 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5820 5.7200 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3010 7.3670 2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9050 6.9530 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1860 5.3060 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0070 6.2450 3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7260 7.8920 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4540 9.3460 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4400 9.1920 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5980 9.0280 4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5490 10.5320 3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7190 9.2320 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9040 9.5530 1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7950 4.8420 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9200 3.7780 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 4.2450 0.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 3.6560 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3000 6.8540 1.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.2790 7.3540 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 8 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 73 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 73 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 23 75 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 24 75 1 0 0 0 0 26 27 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 27 28 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 28 29 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 29 30 2 0 0 0 0 29 35 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 71 1 0 0 0 0 32 33 1 0 0 0 0 32 72 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 73 74 1 0 0 0 0 75 76 1 0 0 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