NCID-ZINC05085322 MOE2007 3D Structure written by MMmdl. 74 78 0 0 1 0 0 0 0 0999 V2000 9.6300 7.2930 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0750 8.7090 -1.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6980 9.2070 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1190 9.5550 -2.9290 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8850 10.5960 -2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 9.0470 -3.9260 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3690 8.0730 -4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6980 8.9880 -3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 8.1970 -2.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8970 7.1300 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7440 8.7070 -1.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 8.3590 -1.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 7.9020 -0.1050 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0960 7.1870 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3690 9.0920 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 10.1190 0.6630 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0320 9.5690 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 8.0970 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 7.2530 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 5.8700 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 5.3180 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 6.1540 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 7.5420 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 8.3920 0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 5.5850 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 6.3620 0.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 4.1290 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 3.6240 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 2.2500 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 1.3810 0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 1.8740 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 3.2660 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 3.8530 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 3.1950 0.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 1.0680 0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -0.3400 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 5.0720 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7370 10.7450 1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 12.0420 2.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 12.6570 3.1790 N 0 5 0 0 0 0 0 0 0 0 0 0 3.4550 14.0150 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 14.6150 4.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 14.6290 2.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 9.8560 3.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7870 11.1910 -0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3860 9.5480 -3.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0640 9.8230 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6930 7.3120 -2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5130 6.7440 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1060 6.7160 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 8.5470 -4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 10.0070 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3390 8.6910 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3360 9.5990 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 10.1590 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 9.6810 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 7.8360 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 4.2910 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 1.8530 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 0.3170 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -0.6450 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.6930 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -0.8090 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 4.1320 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 14.0460 1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 15.6250 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 8.7990 2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 10.0760 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 10.0340 3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 12.0110 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 9.9660 -5.1040 N 0 3 0 0 0 0 0 0 0 0 0 0 7.7130 10.9000 -4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 9.5930 -5.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0680 10.0890 -5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 1 50 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 46 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 71 1 0 0 0 0 8 9 1 0 0 0 0 8 51 1 0 0 0 0 8 52 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 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 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 57 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 58 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 31 2 0 0 0 0 30 60 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 61 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 37 64 1 0 0 0 0 38 39 2 0 0 0 0 38 44 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 43 65 1 0 0 0 0 43 66 1 0 0 0 0 44 67 1 0 0 0 0 44 68 1 0 0 0 0 44 69 1 0 0 0 0 45 70 1 0 0 0 0 46 47 1 0 0 0 0 71 72 1 0 0 0 0 71 73 1 0 0 0 0 71 74 1 0 0 0 0 M CHG 1 40 -1 M CHG 1 71 1 M END