IBS-ZINC04310999 MOE2007 3D Structure written by MMmdl. 49 51 0 0 0 0 0 0 0 0999 V2000 6.0700 2.3850 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 1.3850 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 2.1440 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 1.1430 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 1.8700 -0.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 1.1900 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.0260 -0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 1.9220 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 3.3100 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 4.0040 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 3.3240 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 1.9220 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 1.2170 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -0.1580 -0.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -0.5710 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -2.0930 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 -2.4960 -1.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 1.1980 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -0.0130 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 1.9450 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4690 1.2670 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6560 1.9740 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6430 3.3520 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4440 4.0420 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2410 3.3460 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 4.0730 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 5.2840 0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 3.0100 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0130 1.8450 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 3.0140 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 0.7570 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 0.7610 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 2.7720 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 2.7680 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 0.5150 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 0.5190 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 2.8400 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 3.8470 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 5.0810 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -0.5720 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -0.1080 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.2560 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -2.4080 -2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -2.5570 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 -3.4510 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4860 0.1900 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5980 1.4460 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5750 3.8930 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4420 5.1180 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 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 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END