NCID-ZINC05706431 MOE2007 3D Structure written by MMmdl. 84 88 0 0 1 0 0 0 0 0999 V2000 9.3760 11.1390 1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1260 9.7510 1.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0370 9.0520 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2660 9.3160 0.2690 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4490 10.0950 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9010 8.0010 -0.4400 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9150 7.1910 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 8.0790 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5020 8.5170 -0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4780 7.7890 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8790 9.7960 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 8.5720 -0.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 8.7650 0.2770 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5020 8.6900 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 10.2050 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 10.4070 0.4640 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3730 9.4010 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 7.9750 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 7.6540 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 6.3000 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 5.2790 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 5.6050 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 6.9470 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 7.2880 -0.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 4.5480 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 4.8770 -0.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 3.1400 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 2.1600 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 0.8160 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 0.4490 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 1.4210 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 2.7850 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 3.8660 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 3.6690 0.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 1.1130 0.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -0.2520 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7870 5.9860 0.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 10.3090 1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 9.6890 2.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 11.0550 2.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 11.7320 0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8980 7.6650 -1.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1770 6.3490 -1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6010 5.3850 -1.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2500 6.2100 -2.8730 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9700 7.0310 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9870 4.8740 -2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1120 4.7540 -3.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4750 9.1330 1.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0850 8.6150 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4390 11.8900 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5430 11.4370 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2990 11.1710 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2180 7.1160 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 8.7960 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 10.9140 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 10.4810 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 9.5700 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 9.5590 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 6.4510 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 2.4330 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 0.0510 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -0.6130 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -0.6890 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.8290 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0230 -0.2930 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8360 5.0010 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 12.0820 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 11.0870 3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 10.5440 2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 11.7930 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3710 8.4160 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3960 4.7900 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2890 4.0350 -2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7480 4.7170 -4.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8460 5.5590 -3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8410 3.4820 -3.5250 N 0 3 0 0 0 0 0 0 0 0 0 0 15.6140 3.3780 -4.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2260 2.6650 -3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2480 3.4340 -2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6070 6.3080 -4.1910 N 0 3 0 0 0 0 0 0 0 0 0 0 11.1220 7.2040 -4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 5.6050 -4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3240 6.1940 -4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 51 1 0 0 0 0 1 52 1 0 0 0 0 1 53 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 49 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 42 1 0 0 0 0 8 9 1 0 0 0 0 8 54 1 0 0 0 0 8 55 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 56 1 0 0 0 0 15 57 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 58 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 60 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 32 2 0 0 0 0 28 29 2 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 30 31 2 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 35 36 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 36 66 1 0 0 0 0 37 67 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 68 1 0 0 0 0 40 69 1 0 0 0 0 40 70 1 0 0 0 0 41 71 1 0 0 0 0 42 43 1 0 0 0 0 42 72 1 0 0 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 81 1 0 0 0 0 47 48 1 0 0 0 0 47 73 1 0 0 0 0 47 74 1 0 0 0 0 48 75 1 0 0 0 0 48 76 1 0 0 0 0 48 77 1 0 0 0 0 49 50 1 0 0 0 0 77 78 1 0 0 0 0 77 79 1 0 0 0 0 77 80 1 0 0 0 0 81 82 1 0 0 0 0 81 83 1 0 0 0 0 81 84 1 0 0 0 0 M CHG 1 77 1 M CHG 1 81 1 M END