%chk=000254847.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254847

0 1
S 2.843830 0.455597 1.055951
S -2.859128 0.333927 -1.102805
O 2.677208 1.921010 0.202778
O -2.723987 1.849289 -0.335782
O 1.518288 0.121589 1.533559
O 3.872467 0.703678 2.036134
O -1.526500 0.000805 -1.560984
O -3.892041 0.503303 -2.095188
C 3.387230 -0.565371 -0.195635
C -3.381932 -0.624231 0.205915
C 2.571427 -0.873793 -1.294675
C -2.560582 -0.851755 1.320437
C 4.684841 -1.100472 -0.096351
C -4.668178 -1.190802 0.138531
C 5.174905 -1.958623 -1.078304
C -5.141075 -2.000589 1.168800
C 3.073629 -1.747585 -2.285918
C -3.045344 -1.676729 2.360956
C 4.349631 -2.280407 -2.179450
C -4.310074 -2.240932 2.286293
C 1.216952 -0.293296 -1.434472
C -1.218331 -0.236580 1.425535
C 6.548774 -2.536285 -0.984493
C -6.502687 -2.610913 1.109337
C 1.833367 2.942561 0.748894
C -1.901088 2.855016 -0.940161
C 0.513282 2.878818 0.160069
C -0.580373 2.852725 -0.349322
H 5.313173 -0.835705 0.763033
H -5.301322 -0.989222 -0.734365
H 2.445733 -1.997608 -3.141063
H -2.412984 -1.863819 3.228802
H 4.725652 -2.953141 -2.951960
H -4.672674 -2.875295 3.096749
H 1.236978 0.805995 -1.544822
H 0.639179 -0.666857 -2.295379
H 0.552301 -0.488124 -0.559811
H -0.549806 -0.466780 0.562511
H -1.261038 0.866528 1.473653
H -0.632945 -0.548950 2.305483
H 7.086641 -2.208321 -0.084468
H 6.520674 -3.635094 -0.957122
H 7.165073 -2.244836 -1.847391
H -7.046328 -2.347365 0.191785
H -6.451982 -3.708623 1.146372
H -7.125666 -2.282167 1.953846
H 1.794615 2.877353 1.858288
H 2.358562 3.883324 0.454239
H -1.860230 2.726894 -2.043976
H -2.445920 3.800058 -0.699849


%chk=000254847-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254847

0 1
S 3.035715 0.247292 1.081074
S -3.034564 0.107102 -1.116662
O 2.827009 1.918277 0.221442
O -2.874554 1.841525 -0.379707
O 1.562318 -0.271479 1.522168
O 4.157532 0.414251 2.236559
O -1.545033 -0.404619 -1.508487
O -4.149683 0.161318 -2.289311
C 3.781644 -0.671787 -0.389075
C -3.770494 -0.722970 0.410409
C 2.977064 -1.029110 -1.495054
C -2.970046 -0.972404 1.548118
C 5.151925 -0.951491 -0.248915
C -5.131100 -1.052344 0.278560
C 5.816740 -1.653828 -1.282072
C -5.787629 -1.695070 1.354247
C 3.675844 -1.734175 -2.513560
C -3.660941 -1.619439 2.610131
C 5.049214 -2.038947 -2.412198
C -5.023381 -1.970550 2.518675
C 1.502240 -0.721809 -1.627690
C -1.506915 -0.610230 1.673131
C 7.300278 -1.959540 -1.190754
C -7.257454 -2.062962 1.268844
C 1.808554 2.794597 0.865481
C -1.873549 2.693090 -1.081815
C 0.511439 2.754352 0.183269
C -0.575221 2.723328 -0.401284
H 5.683142 -0.627680 0.652531
H -5.660628 -0.811439 -0.649337
H 3.114239 -2.045026 -3.401527
H -3.101703 -1.844597 3.525047
H 5.536959 -2.587117 -3.227226
H -5.505629 -2.468518 3.368583
H 1.285173 0.346940 -1.457785
H 1.134584 -0.990498 -2.630573
H 0.900065 -1.275290 -0.887423
H -0.879828 -1.187388 0.972851
H -1.324506 0.452939 1.438786
H -1.140909 -0.804784 2.693541
H 7.664137 -1.897871 -0.151338
H 7.526656 -2.970583 -1.573553
H 7.889688 -1.241211 -1.792287
H -7.659662 -1.892387 0.256433
H -7.420382 -3.125784 1.525152
H -7.859394 -1.460582 1.975160
H 1.692379 2.532907 1.936214
H 2.256812 3.803979 0.805937
H -1.754009 2.364760 -2.133662
H -2.341940 3.695054 -1.086844


