PUBCHEM-ZINC04282057 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 73 0 0 1 0 0 0 0 0999 V2000 2.0680 -1.0390 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -1.2420 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -1.8960 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -2.0850 0.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -2.6590 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -2.8720 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -3.4550 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -3.8310 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -3.6160 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -3.0270 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9930 -4.4580 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2780 -4.0230 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2250 -4.8840 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6050 -5.7860 -1.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2360 -5.5070 -1.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2370 -6.8350 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4920 -7.7030 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1180 -8.7370 -3.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4860 -8.9070 -3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2310 -8.0440 -2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6100 -7.0120 -1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5050 -2.8800 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5240 -2.0840 1.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 -0.9980 2.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7220 -0.1710 2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -0.3670 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 0.9970 3.5370 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7690 1.6100 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 0.4820 4.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 1.7840 3.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 3.0920 3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 3.5790 4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 4.9170 4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 5.7800 4.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 5.3180 4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 3.9560 3.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 3.4930 3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 4.3560 3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 5.6940 3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 6.1810 4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 -0.5730 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -2.0040 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -0.3950 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -1.8850 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -0.2760 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -1.2520 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.8610 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -2.5810 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9760 -3.6200 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -3.9060 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 -2.8570 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2830 -4.8490 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4240 -7.5700 -2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5390 -9.4120 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9730 -9.7160 -3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2990 -8.1790 -2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1910 -6.3420 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4880 -2.7060 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6230 -0.8410 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5070 -0.1300 5.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 1.3270 5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2290 -0.1180 4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9930 2.9160 4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2890 5.2770 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 6.8150 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 2.4580 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 3.9980 3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 6.3580 3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 7.2210 4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 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 48 1 0 0 0 0 7 8 1 0 0 0 0 7 49 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 19 20 2 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 2 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 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 29 1 0 0 0 0 27 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 36 1 0 0 0 0 32 33 1 0 0 0 0 32 63 1 0 0 0 0 33 34 2 0 0 0 0 33 64 1 0 0 0 0 34 35 1 0 0 0 0 34 65 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 37 66 1 0 0 0 0 38 39 2 0 0 0 0 38 67 1 0 0 0 0 39 40 1 0 0 0 0 39 68 1 0 0 0 0 40 69 1 0 0 0 0 M END