NCID-ZINC05085483 MOE2007 3D Structure written by MMmdl. 83 87 0 0 1 0 0 0 0 0999 V2000 -2.0000 2.4500 3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 3.1670 3.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 4.1370 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 4.8530 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 5.7820 0.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 6.5270 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 6.4290 1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 7.3810 -0.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 8.1920 -0.6990 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4280 8.4730 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 7.3840 -1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 8.2650 -1.9360 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6360 8.5550 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 9.4360 -2.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 10.2550 -1.8310 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4800 11.1320 -2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 9.4540 -1.4580 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9830 9.1720 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 10.2500 -0.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 10.6980 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 7.5370 -2.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 8.1720 -3.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4830 8.7980 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1720 9.0440 -4.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5850 9.5410 -4.5820 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4100 8.3510 -5.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3080 7.2020 -4.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3160 7.1180 -3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2680 6.0220 -2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2240 5.0120 -2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2450 5.1000 -3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2780 6.1950 -4.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2580 6.2870 -5.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2640 4.0420 -3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1460 4.1190 -4.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2140 2.8860 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1720 1.8810 -2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1200 0.8000 -1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1230 0.7080 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1540 1.7020 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1940 2.7990 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1740 3.8600 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 3.7830 -0.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1760 1.6070 0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2000 0.4580 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 5.9440 -1.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5170 10.5870 -5.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5860 10.6000 -6.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6110 11.6160 -5.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1850 10.0970 -3.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 3.1850 3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 1.8960 2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 1.7600 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 2.4330 3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 3.7210 4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 3.5820 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 4.8710 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 5.4080 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 4.1190 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 5.8600 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 7.4590 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 6.5120 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 7.0590 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 11.0670 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 9.8200 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 11.2680 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 11.3210 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7860 8.4580 -5.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 9.8960 -4.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0420 8.0310 -6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4540 8.6510 -5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0500 6.7510 -4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9570 1.9440 -3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8660 0.0220 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0940 -0.1400 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3650 0.5060 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 -0.4440 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1380 0.4350 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 5.4190 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2970 11.4590 -5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0400 11.5410 -6.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2220 12.5310 -5.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0820 10.4310 -3.5490 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 54 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 56 1 0 0 0 0 3 57 1 0 0 0 0 4 5 1 0 0 0 0 4 58 1 0 0 0 0 4 59 1 0 0 0 0 5 6 1 0 0 0 0 5 60 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 61 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 62 1 0 0 0 0 11 63 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 64 1 0 0 0 0 20 65 1 0 0 0 0 20 66 1 0 0 0 0 20 67 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 68 1 0 0 0 0 24 69 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 70 1 0 0 0 0 26 71 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 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 31 2 0 0 0 0 30 42 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 33 72 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 36 41 2 0 0 0 0 37 38 2 0 0 0 0 37 73 1 0 0 0 0 38 39 1 0 0 0 0 38 74 1 0 0 0 0 39 40 2 0 0 0 0 39 75 1 0 0 0 0 40 41 1 0 0 0 0 40 44 1 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 44 45 1 0 0 0 0 45 76 1 0 0 0 0 45 77 1 0 0 0 0 45 78 1 0 0 0 0 46 79 1 0 0 0 0 47 48 2 0 0 0 0 47 49 1 0 0 0 0 49 80 1 0 0 0 0 49 81 1 0 0 0 0 49 82 1 0 0 0 0 50 83 1 0 0 0 0 M END