CHEMBRIDGE-ZINC02841371 MOE2007 3D Structure written by MMmdl. 47 50 0 0 0 0 0 0 0 0999 V2000 1.3360 0.1640 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 0.4700 2.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 1.2370 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 1.6860 3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 2.4660 3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 2.7980 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 2.3560 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 1.5720 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 1.5590 -1.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 1.2080 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 0.4200 -2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 0.0590 -3.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 0.4820 -4.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 1.2780 -4.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 1.6310 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 1.6860 -5.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 1.3740 -7.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 0.6130 -7.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 0.1120 -6.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -0.5750 -6.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 0.2930 -8.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 0.5040 -9.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 0.2000 -10.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -0.3040 -11.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.5090 -10.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.2140 -9.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -0.6230 -12.6060 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6720 -1.0660 -13.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.4430 -12.9120 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5610 1.0900 4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -0.3780 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -0.4520 3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.4270 4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 2.8160 4.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 3.4080 2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 2.6210 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 0.0930 -1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 -0.5530 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 2.2390 -3.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 1.7420 -7.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 0.9000 -8.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 0.3580 -10.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.9020 -11.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -0.3740 -9.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END