PUBCHEM-ZINC03191061 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 0 0 0 0 0 0999 V2000 0.0520 1.6190 2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 0.1450 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.8450 3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.1050 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -1.7520 1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -0.3980 1.3660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 0.3380 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 1.1450 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 1.8690 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 1.7910 -2.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 0.9880 -1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 0.2570 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 2.7840 -3.7900 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -2.7050 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -3.4650 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -4.4960 2.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -5.7640 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -6.0830 4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -7.3610 4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -8.3320 4.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -8.0270 3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -6.7380 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -9.0690 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -8.8020 1.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -10.3140 2.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -11.2760 2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -12.4820 1.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -13.1210 1.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -12.3000 1.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -11.1610 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -10.2170 2.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 -12.6080 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7090 -12.4160 2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0380 -12.7210 2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4470 -13.2170 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5260 -13.4100 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1960 -13.1010 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -14.4520 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -13.0300 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 1.9830 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 2.1560 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 1.7850 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.7350 4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 1.2070 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 2.4970 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 0.9290 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -0.3730 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -2.9420 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -2.2410 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -3.6200 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -3.6120 4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -5.3280 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -7.6020 5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -9.3300 4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -6.4960 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -10.5470 3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 -12.0290 3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7600 -12.5720 3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4870 -13.4550 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 -13.7970 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -13.2480 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -14.8850 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -15.0920 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 -14.3710 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -12.3030 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -13.9570 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -13.2260 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 43 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 16 2 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 20 21 2 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 55 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 56 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 39 1 0 0 0 0 28 29 1 0 0 0 0 28 38 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 30 31 2 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 35 36 2 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 37 61 1 0 0 0 0 38 62 1 0 0 0 0 38 63 1 0 0 0 0 38 64 1 0 0 0 0 39 65 1 0 0 0 0 39 66 1 0 0 0 0 39 67 1 0 0 0 0 M END