PUBCHEM-ZINC05434323 MOE2007 3D Structure written by MMmdl. 72 76 0 0 1 0 0 0 0 0999 V2000 0.1160 0.8390 4.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 0.3050 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -0.0040 2.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 0.2330 1.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -0.3110 0.6490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1670 -1.0570 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -1.0740 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -0.1170 -0.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1270 0.5330 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -0.8640 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 0.1200 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 1.1090 -2.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9010 0.5370 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0320 2.1960 -2.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0140 2.7970 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 1.8120 -2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1480 3.1520 -2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 3.9430 -3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 5.0870 -3.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 3.1250 -3.4660 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4260 3.8750 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 2.8940 -2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 1.8200 -1.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7400 2.3830 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 0.7930 -1.5450 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1420 1.5650 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 0.8740 -0.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2360 1.6540 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 0.5690 -0.9710 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4360 0.1750 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 1.4840 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 2.5560 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 1.8350 -1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -0.4970 -2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -0.0150 -2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 2.4520 -4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 0.1930 4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 0.8530 5.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 1.8600 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -1.7350 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -1.7290 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -1.5490 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -1.4830 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 -0.4460 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 0.6680 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9460 1.3890 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 1.0800 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5090 3.6720 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9520 3.0220 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 4.5160 -2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 4.5490 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 3.4830 -2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 2.4140 -3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 2.0130 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 2.4240 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -0.5560 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -0.2830 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 1.4390 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 1.7080 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 3.1000 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 3.2950 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 1.4950 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 2.4400 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -0.0820 -2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -0.7560 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -1.3800 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -0.8590 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -0.4410 -3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 0.6100 -3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 1.7000 -4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 1.9630 -5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 3.2010 -5.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 35 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 36 72 1 0 0 0 0 M CHG 1 29 1 M END