%chk=000196070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196070

0 1
S 0.819363 -1.300789 2.742966
O -1.758441 0.168524 -1.502395
O -0.653368 -0.567366 0.405192
O -4.960230 -1.322283 0.552531
O -4.995842 1.239645 -1.107399
O -2.735402 -2.925451 -0.532126
O -0.869895 2.765026 -0.466635
O -1.980161 1.998349 1.326590
O 5.066701 1.151445 -2.172614
N 4.856067 0.276170 -0.049566
C -4.017194 -0.878740 -0.432455
C -3.915972 0.661752 -0.381607
C -2.712271 -1.589440 -0.017374
C -2.577495 1.194866 -0.942381
C -1.471753 -0.976039 -0.698782
C -1.808762 1.975210 0.131702
C 0.703260 -0.348403 0.175924
C 1.517438 -0.616981 1.285863
C 1.229834 0.157883 -1.016028
C 2.887031 -0.396313 1.201684
C 2.604926 0.368905 -1.107733
C 3.437739 0.087061 -0.007472
C -0.359203 -0.041121 3.283662
C 5.593150 0.797148 -1.137473
C 7.073222 0.867368 -0.883406
H -4.353357 -1.232053 -1.435072
H -4.104488 1.031249 0.664300
H -2.602884 -1.609931 1.096709
H -2.742424 1.858838 -1.834527
H -0.949460 -1.653887 -1.410558
H -5.830344 -0.880406 0.414554
H -4.978480 0.977813 -2.055488
H -3.382735 -3.465083 -0.016681
H 0.574494 0.398241 -1.856473
H -0.307871 3.266831 0.189386
H 3.522147 -0.599397 2.064686
H 3.033260 0.760262 -2.040160
H 5.359904 -0.000408 0.795060
H -0.976997 -0.478579 4.077217
H -1.027955 0.283718 2.469203
H 0.147640 0.843925 3.680511
H 7.327668 1.516063 -0.034968
H 7.581561 1.288018 -1.768760
H 7.518079 -0.120540 -0.704009


%chk=000196070-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196070

0 1
S 1.004719 -1.187152 2.959728
O -1.823777 0.306793 -1.499585
O -0.655610 -0.472220 0.477510
O -5.124826 -1.660343 -0.059203
O -5.279979 1.118774 -1.115446
O -2.611072 -2.966667 -0.414588
O -1.012132 2.736080 -0.156792
O -2.496368 2.036065 1.490079
O 5.224485 1.004263 -2.348273
N 4.937935 0.237163 -0.146842
C -4.010153 -0.954166 -0.694140
C -4.093642 0.560230 -0.439572
C -2.733615 -1.549489 -0.084130
C -2.771259 1.255388 -0.865574
C -1.483841 -0.852552 -0.660367
C -2.106488 2.013277 0.302811
C 0.730663 -0.260392 0.259616
C 1.596794 -0.512620 1.357075
C 1.255437 0.198780 -0.969512
C 2.983374 -0.324724 1.183142
C 2.644285 0.366709 -1.143508
C 3.522354 0.096147 -0.061921
C -0.146308 0.195039 3.545774
C 5.711570 0.660930 -1.231808
C 7.214501 0.669164 -0.946629
H -4.009896 -1.144892 -1.790333
H -4.293214 0.746689 0.628845
H -2.767271 -1.397752 1.014233
H -2.965233 1.993161 -1.663566
H -0.935864 -1.524760 -1.341863
H -5.964889 -1.184528 -0.285772
H -5.184503 0.991488 -2.096032
H -3.434618 -3.417896 -0.094400
H 0.572547 0.447668 -1.786630
H -0.555556 3.186508 0.604615
H 3.643206 -0.517884 2.037863
H 3.052499 0.714399 -2.093477
H 5.452470 -0.012236 0.701461
H -0.574222 -0.158111 4.497432
H -0.944618 0.357104 2.809374
H 0.430345 1.117337 3.713723
H 7.461902 1.341028 -0.103721
H 7.738496 1.023261 -1.845702
H 7.581876 -0.343964 -0.698298


