%chk=000255434.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255434

0 1
S -1.667338 3.084023 2.770296
S 1.700608 -2.735424 3.032779
O -0.093065 2.786363 2.189549
O 0.117838 -2.495510 2.448318
O 1.997381 -0.764269 -0.448935
O -2.013850 0.780334 -0.495535
O -1.589230 4.282333 3.550391
O -2.061018 1.835158 3.388663
O 1.634815 -3.851488 3.927583
O 2.101766 -1.432059 3.519970
N 0.945731 1.099483 0.355175
N -0.950217 -0.996592 0.472776
C 0.675214 0.525878 1.690272
C -0.660011 -0.294686 1.740784
C 0.657813 1.685080 2.715172
C -0.626306 -1.347541 2.874239
C 1.574733 0.374675 -0.643743
C -1.593792 -0.372747 -0.583386
C 1.706747 1.081320 -1.957056
C -1.744744 -1.205094 -1.818705
C -2.474683 3.336951 1.273620
C 2.487079 -3.134122 1.556883
C 2.973594 1.171737 -2.548957
C -3.020186 -1.352636 -2.379864
C 0.581039 1.614097 -2.600019
C -0.628228 -1.799120 -2.422841
C 3.115124 1.810478 -3.784004
C -3.179478 -2.109691 -3.543851
C 0.729740 2.245646 -3.837552
C -0.794738 -2.549249 -3.589905
C 1.994681 2.346996 -4.427185
C -2.068224 -2.707445 -4.147782
H 1.536946 -0.155875 1.962399
H -1.518094 0.411160 1.957495
H 1.676852 2.107284 2.846194
H 0.272574 1.355310 3.698490
H -1.642847 -1.754365 3.061245
H -0.226924 -0.922882 3.814614
H 0.541501 2.024047 0.179686
H -0.548208 -1.934354 0.383103
H -2.394291 2.463865 0.575247
H -3.558454 3.505441 1.366959
H -2.091913 4.190762 0.692942
H 2.392574 -2.335454 0.776064
H 3.572909 -3.288824 1.650311
H 2.099952 -4.042948 1.070201
H 3.840581 0.739538 -2.046906
H -3.880017 -0.872720 -1.909888
H -0.411692 1.529561 -2.145746
H 0.371055 -1.670848 -1.993901
H 4.098424 1.887278 -4.245917
H -4.169474 -2.231047 -3.981254
H -0.142830 2.657210 -4.343551
H 0.070589 -3.009042 -4.065926
H 2.106845 2.843029 -5.390978
H -2.194251 -3.295808 -5.056335


%chk=000255434-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255434

0 1
S -2.013860 3.070996 2.894066
S 2.050911 -2.701862 3.156729
O -0.330783 2.828445 2.043120
O 0.354778 -2.549739 2.311140
O 2.268907 -0.684098 -0.284937
O -2.303183 0.696961 -0.311076
O -1.991635 4.457113 3.716314
O -2.353367 1.681430 3.670239
O 2.043762 -3.993711 4.120477
O 2.401483 -1.238998 3.777933
N 0.919921 1.102011 0.334793
N -0.910113 -0.998624 0.448272
C 0.649460 0.585901 1.678364
C -0.625819 -0.351997 1.730889
C 0.519962 1.776021 2.649160
C -0.488210 -1.438822 2.815470
C 1.676588 0.413174 -0.583282
C -1.697042 -0.414004 -0.515630
C 1.791193 1.020619 -1.953630
C -1.830699 -1.151957 -1.818791
C -3.028895 3.241648 1.303339
C 3.040362 -3.038366 1.576449
C 2.945314 0.717875 -2.719905
C -2.994629 -0.919302 -2.594518
C 0.780010 1.848199 -2.509832
C -0.830262 -2.034017 -2.306712
C 3.104062 1.259507 -4.011970
C -3.173569 -1.581115 -3.826545
C 0.937938 2.382552 -3.806826
C -1.008496 -2.689271 -3.544311
C 2.102356 2.097617 -4.557114
C -2.182305 -2.472000 -4.302631
H 1.530668 -0.002953 1.993175
H -1.503761 0.267186 1.991663
H 1.498735 2.253612 2.826511
H 0.097675 1.443315 3.617571
H -1.465896 -1.894152 3.048513
H -0.056934 -1.011403 3.741749
H 0.468504 1.987507 0.090817
H -0.448576 -1.896645 0.282055
H -2.848341 2.316820 0.728294
H -4.070368 3.365403 1.633171
H -2.636739 4.141622 0.809942
H 2.843898 -2.180936 0.909896
H 4.087973 -3.121849 1.899320
H 2.645043 -3.987353 1.188714
H 3.701669 0.057154 -2.284071
H -3.742136 -0.216202 -2.213197
H -0.151855 2.039729 -1.963351
H 0.108257 -2.177761 -1.757103
H 4.003228 1.030037 -4.594056
H -4.080215 -1.404405 -4.415355
H 0.148863 3.009287 -4.235966
H -0.227851 -3.358341 -3.921922
H 2.223012 2.516123 -5.562457
H -2.318392 -2.984783 -5.261256


