%chk=000266631.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266631

0 1
O 4.687415 -2.281601 -0.177054
O -2.826617 -1.948224 -0.074350
O -1.608980 -3.919751 -0.144355
N 2.719804 -1.119438 -0.120391
N -0.705614 2.154840 0.013460
N -1.594813 -1.292580 -0.071468
C 0.943267 0.337779 -0.057650
C 2.172278 1.127986 -0.050911
C 3.266916 0.208382 -0.090167
C -0.392334 0.875117 -0.026063
C 1.305628 -0.998510 -0.099411
C -1.666402 -0.006005 -0.034739
C -2.764884 0.980543 0.006419
C 2.431223 2.503514 -0.015785
C -2.143331 2.276520 0.034753
C 4.599704 0.635716 -0.094838
C 3.480378 -2.343329 -0.163787
C 3.756275 2.928990 -0.020397
C 4.824862 2.008119 -0.059369
C -4.139292 0.856209 0.020088
C -2.899780 3.434482 0.076405
C -4.909285 2.038014 0.062571
C -4.302688 3.292455 0.089928
C 2.682587 -3.605066 -0.188891
C -2.667140 -3.362915 -0.115780
C -4.051698 -3.909072 -0.113990
H 0.668263 -1.877661 -0.116008
H 1.602567 3.214266 0.014328
H 5.416479 -0.086929 -0.125136
H 3.979535 3.994517 0.006545
H 5.847626 2.384132 -0.061613
H -4.615553 -0.122874 -0.001225
H -2.429055 4.415730 0.097855
H -5.995544 1.961827 0.073980
H -4.920910 4.190855 0.122629
H 2.044578 -3.725640 0.701343
H 3.353899 -4.480781 -0.221450
H 2.022738 -3.676600 -1.068437
H -4.036910 -5.011173 -0.141118
H -4.612641 -3.602906 0.784096
H -4.631653 -3.559738 -0.983816


%chk=000266631-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266631

0 1
O 4.757990 -2.299825 -0.178328
O -2.879460 -1.954930 -0.073629
O -1.713839 -4.017154 -0.145401
N 2.760978 -1.097926 -0.118364
N -0.689645 2.148288 0.014061
N -1.546807 -1.325065 -0.071726
C 0.974504 0.344596 -0.056118
C 2.207350 1.141776 -0.050679
C 3.308952 0.228406 -0.089665
C -0.381037 0.841749 -0.025577
C 1.358357 -0.998909 -0.097179
C -1.646203 -0.013235 -0.033621
C -2.756544 0.952839 0.006528
C 2.451508 2.534069 -0.016291
C -2.124266 2.240127 0.034148
C 4.649165 0.660716 -0.095364
C 3.499806 -2.317128 -0.162250
C 3.791310 2.978979 -0.021682
C 4.871298 2.056548 -0.060576
C -4.157769 0.833906 0.020538
C -2.885288 3.417128 0.075935
C -4.929034 2.025927 0.062944
C -4.301067 3.294540 0.090107
C 2.684830 -3.599755 -0.187664
C -2.782398 -3.395411 -0.116151
C -4.189034 -3.949620 -0.116335
H 0.715724 -1.874941 -0.112096
H 1.608238 3.228255 0.013490
H 5.471491 -0.055053 -0.125347
H 4.003927 4.053408 0.004587
H 5.900999 2.430751 -0.063883
H -4.638897 -0.146686 -0.000661
H -2.393625 4.394094 0.096820
H -6.022199 1.963096 0.074727
H -4.918483 4.199131 0.122653
H 2.049569 -3.698798 0.710721
H 3.387336 -4.444344 -0.224771
H 2.019654 -3.644936 -1.068538
H -4.148357 -5.047840 -0.144259
H -4.730714 -3.620959 0.787415
H -4.747422 -3.576612 -0.992321


