%chk=000256636.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256636

0 1
O -1.807108 -1.121513 1.617221
O -2.786814 -0.472519 -1.392098
O 1.095316 3.237546 0.521069
O 3.519432 0.485556 -0.054603
O -3.153016 0.705155 1.572488
O -1.852922 1.437594 -2.178671
O 2.420288 0.197789 1.910453
N -0.809678 1.949401 0.415114
C 0.111507 -0.229025 -0.033061
C -1.229585 0.587420 0.055063
C 1.220237 0.853305 -0.126946
C 0.149026 -1.229704 -1.188486
C 0.574377 2.172721 0.307366
C 1.384864 -2.135578 -1.107365
C -2.197196 0.098687 1.156891
C -1.969842 0.620280 -1.304238
C 2.403265 0.485507 0.739437
C 1.401668 -3.159062 -2.251123
C 2.636539 -4.054426 -2.183431
C -2.569133 -1.711830 2.729448
C -3.657492 -0.594919 -2.569820
C 4.807926 0.155782 0.562377
C -2.155395 -1.055571 4.026502
C -4.824787 0.356418 -2.438483
C 4.910525 -1.340023 0.769153
H 0.228974 -0.790031 0.937197
H 1.564580 0.980276 -1.192314
H -0.773447 -1.851815 -1.160056
H 0.132339 -0.708417 -2.166803
H -1.497423 2.675115 0.599618
H 1.406569 -2.663086 -0.133391
H 2.310200 -1.523813 -1.140553
H 1.373966 -2.635751 -3.227337
H 0.486237 -3.781866 -2.214754
H 2.640025 -4.785241 -3.000483
H 3.562499 -3.473201 -2.262114
H 2.679156 -4.615860 -1.243091
H -3.645966 -1.601730 2.511724
H -2.251341 -2.767577 2.646326
H -3.048780 -0.410392 -3.472173
H -3.945339 -1.659820 -2.492900
H 4.900526 0.726600 1.503597
H 5.504439 0.543617 -0.203974
H -2.561453 -1.588242 4.895125
H -2.510211 -0.015071 4.084071
H -1.061813 -1.026278 4.136526
H -5.300718 0.279944 -1.450359
H -4.509027 1.403799 -2.560886
H -5.594654 0.156625 -3.193829
H 4.209818 -1.683703 1.545367
H 4.677694 -1.894155 -0.149244
H 5.919049 -1.631017 1.087652


%chk=000256636-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256636

0 1
O -2.128781 -1.285100 1.506393
O -2.993671 -0.216277 -1.277442
O 1.221241 3.184539 0.555715
O 3.602946 0.859674 -0.312878
O -3.049597 0.839463 1.787737
O -1.446149 1.287889 -2.165696
O 2.672555 -0.024786 1.637584
N -0.731825 1.871690 0.568202
C 0.128936 -0.298806 0.110183
C -1.208737 0.541195 0.189773
C 1.215642 0.770388 -0.188565
C 0.097101 -1.493238 -0.865923
C 0.616857 2.105419 0.352169
C 1.378830 -2.355457 -0.807654
C -2.230821 0.064053 1.241398
C -1.883533 0.606597 -1.214756
C 2.541521 0.476336 0.495827
C 1.301032 -3.597293 -1.724228
C 2.583662 -4.454942 -1.676317
C -3.090407 -1.845750 2.515178
C -3.741958 -0.249201 -2.580410
C 4.976111 0.707710 0.265952
C -2.534397 -1.684140 3.931280
C -4.741165 0.907026 -2.651660
C 5.526174 -0.693840 -0.012721
H 0.314918 -0.680307 1.132342
H 1.387144 0.904439 -1.271545
H -0.776196 -2.125862 -0.615721
H -0.046495 -1.129152 -1.904210
H -1.372908 2.593739 0.903290
H 1.559258 -2.678571 0.237893
H 2.258869 -1.748034 -1.103205
H 1.111089 -3.271294 -2.767398
H 0.428940 -4.215202 -1.427298
H 2.505492 -5.338563 -2.335869
H 3.464441 -3.868673 -2.000144
H 2.780962 -4.815314 -0.649181
H -4.057382 -1.327260 2.394968
H -3.181063 -2.902433 2.218163
H -3.006397 -0.203551 -3.402454
H -4.237497 -1.232416 -2.562597
H 4.922258 0.913699 1.348861
H 5.556717 1.492728 -0.243488
H -3.213093 -2.175582 4.652757
H -2.456572 -0.618734 4.204112
H -1.538619 -2.150746 4.021772
H -5.425565 0.891333 -1.786475
H -4.219036 1.877833 -2.678143
H -5.345132 0.816489 -3.573338
H 4.930489 -1.460440 0.510973
H 5.522681 -0.911435 -1.094938
H 6.569030 -0.761940 0.348931


