%chk=000234980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234980

0 1
S 0.602022 0.152472 -1.248472
P 0.423619 0.068514 0.649949
N 0.421247 1.611828 1.505413
N 1.679366 -0.792025 1.543449
N -1.017585 -0.722648 1.290632
C 0.119363 2.768427 0.693387
C 2.449939 -1.778942 0.837956
C -2.143167 -0.916999 0.420797
C -1.089411 3.463786 0.886280
C 3.855382 -1.745480 0.941973
C -2.741828 -2.191483 0.356602
C 1.071330 3.234347 -0.231200
C 1.815736 -2.822304 0.136921
C -2.700866 0.165606 -0.286112
C -1.340210 4.621958 0.147989
C 4.614533 -2.752570 0.345166
C -3.889656 -2.374649 -0.415836
C 0.795538 4.388554 -0.967464
C 2.596785 -3.813575 -0.461461
C -3.842782 -0.044412 -1.061363
C -0.403657 5.084518 -0.781469
C 3.991118 -3.787331 -0.359130
C -4.442127 -1.306571 -1.128822
H -0.122496 1.613657 2.396878
H 2.258906 -0.203232 2.178773
H -0.847638 -1.527290 1.929799
H -1.826710 3.107644 1.601862
H 4.351557 -0.939551 1.476318
H -2.316355 -3.031098 0.899139
H 2.014177 2.707893 -0.379790
H 0.733516 -2.876097 0.043637
H -2.263411 1.162554 -0.246568
H -2.273747 5.163691 0.295606
H 5.701092 -2.726738 0.424981
H -4.353086 -3.359528 -0.465956
H 1.524858 4.747690 -1.693725
H 2.108822 -4.616416 -1.014878
H -4.269995 0.789015 -1.619682
H -0.607373 5.982427 -1.360615
H 4.587682 -4.565111 -0.829419
H -5.331087 -1.456433 -1.736249


%chk=000234980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234980

0 1
S 0.163998 0.066745 -2.200451
P 0.009574 0.017804 -0.138817
N -0.460640 1.496897 0.683815
N 1.447787 -0.396916 0.781414
N -1.143200 -1.101657 0.571832
C -0.012879 2.820475 0.426452
C 2.405742 -1.406817 0.496757
C -2.461875 -1.394336 0.131334
C -0.737544 3.906886 0.988549
C 3.660129 -1.363887 1.164404
C -3.117090 -2.540332 0.659302
C 1.149099 3.082636 -0.348322
C 2.131622 -2.467577 -0.407912
C -3.148223 -0.560320 -0.791886
C -0.298230 5.231739 0.787783
C 4.617214 -2.375086 0.940996
C -4.442219 -2.837290 0.279444
C 1.569085 4.414580 -0.550365
C 3.104452 -3.465075 -0.630839
C -4.469682 -0.877727 -1.171673
C 0.856973 5.496741 0.016053
C 4.348156 -3.432442 0.041093
C -5.128724 -2.009829 -0.639364
H -1.285610 1.392073 1.281594
H 1.706828 0.305617 1.480400
H -0.731460 -1.736357 1.262249
H -1.641749 3.711956 1.579163
H 3.882530 -0.540100 1.854531
H -2.588150 -3.194569 1.364019
H 1.703739 2.259081 -0.809858
H 1.180363 -2.500374 -0.949009
H -2.646479 0.309507 -1.228436
H -0.865417 6.058360 1.230386
H 5.577952 -2.331046 1.466245
H -4.935569 -3.721792 0.697937
H 2.461423 4.604363 -1.157422
H 2.885000 -4.273764 -1.336976
H -4.985739 -0.232095 -1.891126
H 1.192744 6.526454 -0.143938
H 5.094968 -4.213150 -0.136365
H -6.155495 -2.245279 -0.937700


