%chk=000247061.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247061

0 1
S -4.833005 0.343919 -0.006093
F 5.059517 -1.136734 -0.747886
F 3.820351 1.301550 3.405736
O -3.402932 -2.239911 -1.294427
O -2.665899 0.456770 2.490878
N -1.962292 -1.501724 0.375986
N -2.059779 2.029318 0.903546
N -0.854536 -1.803657 -0.367889
N -0.726548 1.785483 1.126681
C -4.391644 -1.285914 0.695069
C -4.463826 1.516042 1.346386
C -5.581133 -2.210802 0.560718
C -4.864690 2.890429 0.862846
C -3.240320 -1.741082 -0.208735
C -2.994266 1.288899 1.664601
C 1.513762 -1.838455 -0.713921
C 1.596498 2.147729 0.690018
C 0.326210 -1.486251 0.092283
C 0.166783 2.403056 0.404653
C 2.758041 -1.303072 -0.335425
C 2.029972 1.813760 1.982156
C 1.429013 -2.689069 -1.830694
C 2.525108 2.265471 -0.359579
C 3.874434 -1.645340 -1.098669
C 3.398290 1.613832 2.179373
C 2.572260 -3.008566 -2.567716
C 3.885927 2.050570 -0.122679
C 3.820617 -2.489223 -2.211415
C 4.344969 1.723056 1.156914
H -4.089711 -1.197899 1.770074
H -5.054289 1.247430 2.262851
H -5.856248 -2.379819 -0.494739
H -5.362795 -3.202917 0.984095
H -6.469156 -1.822449 1.076052
H -4.472494 3.142735 -0.132278
H -5.961728 2.980435 0.790778
H -4.532725 3.673639 1.561232
H -1.876577 -1.050067 1.308666
H -2.377724 2.647059 0.146194
H 0.533816 -0.963572 1.040825
H -0.026275 3.108610 -0.417471
H 2.846423 -0.638766 0.524137
H 1.314671 1.713238 2.801789
H 0.457559 -3.098349 -2.123014
H 2.187606 2.511709 -1.365215
H 2.490570 -3.670618 -3.430424
H 4.598800 2.134335 -0.944822
H 4.713805 -2.736803 -2.780197
H 5.404793 1.553683 1.344254


%chk=000247061-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247061

0 1
S -4.803135 0.485383 -0.160051
F 5.096116 -2.192216 0.050936
F 4.243387 0.565173 2.092089
O -3.552876 -2.485002 -1.574219
O -2.391691 0.154551 2.245757
N -2.109384 -1.768229 0.145152
N -1.963279 2.161098 1.121467
N -0.968360 -2.191576 -0.509379
N -0.591055 1.985840 1.190059
C -4.521043 -1.356933 0.381551
C -4.308711 1.426229 1.444642
C -5.816425 -2.149538 0.172229
C -4.805022 2.875065 1.301702
C -3.363419 -1.931023 -0.460352
C -2.814782 1.201660 1.662770
C 1.440414 -2.371594 -0.573825
C 1.631916 2.763385 0.656130
C 0.189743 -1.939151 0.067794
C 0.170118 2.890404 0.611415
C 2.682023 -2.076977 0.054331
C 2.245707 1.704262 1.381689
C 1.434645 -3.074872 -1.814404
C 2.445085 3.701297 -0.037373
C 3.866173 -2.490612 -0.574423
C 3.640061 1.618292 1.378211
C 2.645500 -3.473576 -2.410793
C 3.851962 3.580026 -0.015700
C 3.889174 -3.184871 -1.795094
C 4.471573 2.528193 0.695453
H -4.243136 -1.290022 1.447650
H -4.826261 0.920231 2.275499
H -6.068308 -2.199847 -0.899807
H -5.681086 -3.187548 0.529508
H -6.652227 -1.687547 0.723749
H -4.447721 3.359278 0.372539
H -5.906971 2.886876 1.261065
H -4.486014 3.484974 2.166795
H -2.049434 -1.250607 1.046475
H -2.370589 2.966227 0.622896
H 0.272833 -1.399550 1.031546
H -0.241811 3.764087 0.066802
H 2.734927 -1.540777 1.007941
H 1.630350 0.985860 1.930185
H 0.470374 -3.292292 -2.282914
H 1.975951 4.518131 -0.598258
H 2.632166 -4.014534 -3.362836
H 4.471637 4.302452 -0.556162
H 4.842195 -3.485406 -2.239641
H 5.557915 2.407025 0.724708


