%chk=000275302.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275302

0 1
O 0.445001 3.955586 1.568634
O -1.414457 1.609126 -1.714795
O 3.759605 -3.566539 -0.008541
N -0.365601 1.045767 0.226058
N -0.655513 4.084404 -0.417768
N -4.535818 -1.104430 -0.448760
C 0.701076 2.057723 0.050571
C 1.940956 1.708292 0.892507
C 2.418370 0.302316 0.674809
C 0.153635 3.439454 0.503327
C 2.386343 -0.621489 1.727910
C 2.908950 -0.093784 -0.585049
C -1.333412 0.849459 -0.758126
C 2.829924 -1.934154 1.541757
C 3.353281 -1.393735 -0.797647
C -2.251599 -0.301945 -0.528846
C 3.307997 -2.300171 0.277447
C -1.770754 -1.593764 -0.277862
C -3.644580 -0.097880 -0.620813
C -2.684764 -2.635719 -0.107040
C -4.058234 -2.352044 -0.195894
H 0.978735 2.109822 -1.040187
H 1.728812 1.906802 1.969226
H 2.753344 2.430355 0.650447
H -0.310203 0.461180 1.056168
H 2.020922 -0.319039 2.709929
H 2.943091 0.625936 -1.403923
H 2.810307 -2.643396 2.362552
H 3.736357 -1.721265 -1.762387
H -1.097403 4.956856 -0.168407
H -1.024036 3.606676 -1.238834
H -0.697011 -1.787469 -0.227652
H -4.059691 0.895698 -0.841590
H -2.342203 -3.650417 0.085313
H -4.814061 -3.137531 -0.066708
H 3.746032 -4.155481 0.784875


%chk=000275302-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275302

0 1
O 0.662432 4.141198 1.559620
O -1.542260 1.741263 -1.647975
O 3.695230 -3.672803 -0.142441
N -0.362520 1.116923 0.254156
N -0.732323 4.093732 -0.312361
N -4.432695 -1.284868 -0.902469
C 0.699992 2.133444 0.092348
C 1.956780 1.734108 0.902889
C 2.418076 0.306756 0.646202
C 0.210139 3.555882 0.530623
C 2.388606 -0.662449 1.679211
C 2.883841 -0.100174 -0.634011
C -1.360126 0.925188 -0.676423
C 2.804319 -1.995850 1.453181
C 3.301547 -1.421344 -0.879340
C -2.229999 -0.283535 -0.493371
C 3.261233 -2.372419 0.168395
C -1.782440 -1.483522 0.117403
C -3.558174 -0.243776 -0.995731
C -2.676157 -2.571160 0.219030
C -3.985049 -2.426947 -0.297027
H 0.926853 2.179737 -0.990567
H 1.744958 1.896279 1.975332
H 2.749578 2.460404 0.646731
H -0.297190 0.497343 1.064386
H 2.057500 -0.370416 2.683870
H 2.926524 0.629041 -1.452446
H 2.783613 -2.725405 2.273519
H 3.664843 -1.734002 -1.862679
H -1.123652 5.009473 -0.089891
H -1.115674 3.516096 -1.078252
H -0.748472 -1.588637 0.468283
H -3.918500 0.661165 -1.495639
H -2.364727 -3.517090 0.672350
H -4.706105 -3.250172 -0.240630
H 3.663397 -4.258264 0.654424


