%chk=000257012.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257012

0 1
O -2.613791 -2.186433 0.454849
O 0.698245 2.548319 2.476590
O -0.684244 -2.993026 -0.407031
N -1.102562 1.334091 1.791988
C -1.726892 0.321750 0.898121
C -0.737988 -0.770854 0.551377
C -2.261993 0.941958 -0.388866
C 0.264524 1.610266 1.819042
C 1.164297 0.684473 1.047811
C 0.593950 -0.584337 0.605070
C -2.040403 2.243781 2.492307
C -1.577435 1.964585 -1.056834
C -3.466583 0.451565 -0.915105
C -1.276123 -2.086516 0.134293
C 2.440994 1.066083 0.844550
C -2.102872 2.503439 -2.235509
C -3.986789 0.990589 -2.093835
C 3.456854 0.305730 0.103933
C -3.307489 2.019980 -2.754454
C -3.290501 -3.450688 0.154549
C 4.718753 0.101342 0.689667
C 3.196389 -0.193828 -1.182326
C 5.700336 -0.611673 -0.001103
C 4.187354 -0.898980 -1.870865
C -2.939939 -4.481069 1.206490
C 5.437032 -1.111925 -1.281408
H -2.584888 -0.139773 1.475188
H 1.298280 -1.384392 0.338083
H -1.473375 3.019098 3.047390
H -2.645495 1.679277 3.219940
H -2.709287 2.753836 1.779419
H -0.635822 2.345650 -0.662805
H -3.988267 -0.362509 -0.409030
H 2.788848 2.027597 1.261311
H -1.569519 3.301542 -2.749753
H -4.921847 0.608136 -2.499358
H -3.714867 2.441400 -3.671479
H -4.347698 -3.131308 0.189260
H -3.005450 -3.767795 -0.864856
H 4.927233 0.491390 1.685561
H 2.225571 -0.024185 -1.648268
H 6.674440 -0.777081 0.457712
H 3.981930 -1.285601 -2.868669
H -3.088268 -4.090520 2.221520
H -3.550785 -5.385565 1.102624
H -1.884870 -4.785741 1.128081
H 6.205813 -1.665781 -1.818170


%chk=000257012-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257012

0 1
O -2.696442 -2.214351 0.297740
O 0.839469 2.550118 2.374043
O -0.642982 -3.069121 -0.425494
N -1.037398 1.336896 1.712711
C -1.723760 0.306033 0.892386
C -0.776267 -0.809985 0.489118
C -2.408542 0.939265 -0.342993
C 0.334396 1.571893 1.730247
C 1.200077 0.596076 0.964122
C 0.584175 -0.628125 0.487630
C -1.926579 2.264811 2.433677
C -1.659985 1.733762 -1.246908
C -3.788586 0.737834 -0.578976
C -1.314596 -2.125874 0.068767
C 2.542946 0.918014 0.873267
C -2.284264 2.315486 -2.371396
C -4.415819 1.319451 -1.704775
C 3.629380 0.239076 0.162034
C -3.665029 2.109627 -2.604455
C -3.345404 -3.506334 -0.079821
C 4.964780 0.468395 0.616497
C 3.446579 -0.600795 -0.979577
C 6.064638 -0.153546 -0.005110
C 4.549888 -1.213543 -1.607047
C -3.239829 -4.522310 1.061205
C 5.861540 -1.003767 -1.118530
H -2.524712 -0.131794 1.518992
H 1.214055 -1.469031 0.177440
H -1.298543 2.997681 2.961569
H -2.545746 1.710137 3.163773
H -2.593861 2.793154 1.727846
H -0.591652 1.904023 -1.068573
H -4.366446 0.115375 0.114070
H 2.822260 1.821248 1.436581
H -1.697672 2.929675 -3.063826
H -5.486012 1.159018 -1.877709
H -4.149462 2.562737 -3.476635
H -4.389520 -3.221442 -0.288025
H -2.862774 -3.883708 -0.998170
H 5.125322 1.130372 1.475927
H 2.448765 -0.733318 -1.408087
H 7.077810 0.027505 0.369949
H 4.388563 -1.846812 -2.486280
H -3.671049 -4.117197 1.993074
H -3.795104 -5.440742 0.794210
H -2.187431 -4.796847 1.242362
H 6.715625 -1.482723 -1.609852


