NCID-ZINC05437722 MOE2007 3D Structure written by MMmdl. 82 86 0 0 1 0 0 0 0 0999 V2000 5.6680 -0.8790 -3.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 -0.6600 -2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 0.3450 -2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 0.5630 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.7640 -0.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6360 1.7230 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.6880 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 3.1420 -0.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4210 4.2160 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 5.5920 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 5.8100 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 7.1130 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 8.1970 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 7.9730 -0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 6.6710 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 6.4470 -1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 9.1080 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 8.9150 -1.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 10.4820 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 11.5610 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 12.8470 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 13.0720 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 12.0080 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 10.7040 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 9.5670 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 9.7600 0.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 12.2340 0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 13.5920 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 7.3210 1.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 4.6900 0.8690 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7210 4.9930 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 3.4270 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 4.4140 -0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 4.5340 0.4590 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7070 5.4570 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6440 4.5620 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 3.2380 -1.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5840 3.1290 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 2.0820 -0.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7220 1.1330 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 2.1500 0.6570 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8000 2.0280 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 3.4180 1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 1.0350 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 2.1900 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 3.1800 -1.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 0.0680 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 -1.5950 -3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -1.2660 -4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 -0.2740 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -1.6080 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -0.0420 -3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 1.2920 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 0.9500 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -0.3840 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -0.2940 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 0.8620 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 0.7290 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 4.0790 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 4.1200 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 6.2950 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 11.3960 -1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 13.6810 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 14.0800 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 14.0030 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 13.6320 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 14.1760 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 7.2400 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 2.5870 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 3.5800 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 4.6940 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 5.3860 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 0.0670 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 1.1080 2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 1.1350 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3750 1.4890 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 2.3360 -2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 4.0270 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 1.5330 -1.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 2.4220 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 3.2280 -2.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5320 3.3620 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 50 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 52 1 0 0 0 0 3 53 1 0 0 0 0 4 54 1 0 0 0 0 4 55 1 0 0 0 0 4 79 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 79 1 0 0 0 0 7 56 1 0 0 0 0 7 57 1 0 0 0 0 7 58 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 59 1 0 0 0 0 9 60 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 61 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 62 1 0 0 0 0 21 22 1 0 0 0 0 21 63 1 0 0 0 0 22 23 2 0 0 0 0 22 64 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 27 28 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 68 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 43 1 0 0 0 0 36 37 1 0 0 0 0 36 71 1 0 0 0 0 36 72 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 81 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 45 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 44 73 1 0 0 0 0 44 74 1 0 0 0 0 44 75 1 0 0 0 0 45 76 1 0 0 0 0 46 78 1 0 0 0 0 77 81 1 0 0 0 0 79 80 1 0 0 0 0 81 82 1 0 0 0 0 M END