IBS-ZINC02132712 MOE2007 3D Structure written by MMmdl. 43 45 0 0 0 0 0 0 0 0999 V2000 3.5190 -2.2150 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 -0.8510 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -0.0900 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -0.7180 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -2.1050 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -2.8470 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -4.2030 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 -4.8360 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -4.1980 1.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 -6.3400 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 -6.8020 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -8.3300 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -8.7920 3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -10.3200 3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 -10.3360 5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 0.0200 0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 1.3540 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.0890 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 1.3840 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 1.9900 -0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 3.5700 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 4.3840 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 5.6470 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 5.5480 0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 4.3960 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -2.8060 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -0.3640 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -2.6030 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -6.7600 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -6.6790 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -6.3820 2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -6.4640 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -8.7500 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 -8.6690 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -8.3720 3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -8.4530 4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -10.7400 3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 -10.6580 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 1.8710 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 4.0670 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 6.5590 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 -10.7540 5.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -10.4540 5.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 42 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 25 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 42 43 1 0 0 0 0 M END