%chk=000281392.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281392

0 1
S -5.090364 0.478343 1.402628
S -5.593795 -3.810387 0.307344
O -5.405263 0.442472 2.799551
O -5.927059 1.110703 0.427300
O 4.876852 1.919335 0.826720
O 1.913383 3.427228 -1.924357
N 3.685775 0.487079 -0.550168
N -4.831825 -1.195948 0.874265
N 1.405738 1.900391 0.316224
N 0.446807 2.545220 0.771883
N -7.134808 -1.905487 1.183587
N -7.920840 -2.989846 1.052464
C 4.640113 -0.578457 -0.703993
C 5.134519 -2.723514 -1.712921
C 6.782767 -1.623338 -0.303259
C 2.687138 2.639633 0.216158
C 5.898272 -0.550036 -0.097090
C 4.244600 -1.662374 -1.514815
C -3.458036 1.011059 1.194959
C 6.402504 -2.703669 -1.107049
C 3.862971 1.633247 0.220204
C -2.556604 0.925746 2.262915
C -3.056106 1.568923 -0.025044
C -0.849229 1.920946 0.881474
C 4.746101 -3.884900 -2.569289
C 8.126988 -1.592818 0.347126
C -1.243655 1.371388 2.114361
C -1.747942 2.019529 -0.195970
C 2.759799 3.502684 -1.073537
C 3.943030 4.406368 -1.125599
C -5.849725 -2.114779 0.840662
C -7.326106 -4.078203 0.614928
H 2.857304 3.329602 1.096678
H 6.199061 0.291060 0.533193
H 3.266633 -1.680013 -1.985183
H 7.087292 -3.532154 -1.265844
H 2.770900 0.333339 -0.995470
H -2.882365 0.512944 3.227098
H -3.772729 1.659949 -0.852338
H 3.731231 -3.798037 -2.977596
H 5.429401 -3.992193 -3.424896
H 4.787232 -4.827511 -2.003846
H 8.696422 -0.701729 0.043131
H 8.741772 -2.468527 0.103523
H 8.036221 -1.554628 1.443245
H -0.538855 1.306502 2.943531
H -1.426996 2.454010 -1.145138
H -3.906709 -1.525552 0.576085
H 4.222632 4.640985 -2.166249
H 4.838993 3.995915 -0.628323
H 3.728217 5.371771 -0.638813
H -7.792057 -5.038268 0.447948


%chk=000281392-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281392

0 1
S -4.970845 0.265542 0.546621
S -5.062465 -4.247328 1.471198
O -5.847954 0.879793 1.759746
O -5.432585 0.373762 -0.994535
O 5.152831 2.106763 0.807861
O 2.351990 3.985430 -1.692542
N 3.644026 0.682226 -0.326338
N -4.506652 -1.538306 0.912505
N 1.550104 2.185557 0.260672
N 0.648534 2.559805 1.113247
N -6.755254 -2.316384 0.649691
N -7.527287 -3.481193 0.750606
C 4.434446 -0.463175 -0.635814
C 4.492161 -2.691491 -1.674375
C 6.519515 -1.746718 -0.618804
C 2.844776 2.864316 0.452493
C 5.798753 -0.573958 -0.278471
C 3.786753 -1.519541 -1.331757
C -3.200634 0.923801 0.704228
C 5.861182 -2.791362 -1.308408
C 4.009563 1.830077 0.338496
C -2.819306 1.479117 1.937063
C -2.383329 0.895276 -0.441279
C -0.648355 1.963741 0.912274
C 3.807993 -3.826474 -2.416794
C 7.989184 -1.860585 -0.250961
C -1.518864 2.017519 2.030720
C -1.082360 1.422436 -0.330411
C 3.058919 3.957601 -0.660137
C 4.166233 4.943527 -0.354112
C -5.473945 -2.513470 0.971716
C -6.849585 -4.542507 1.149089
H 2.923704 3.357556 1.440593
H 6.285467 0.244847 0.256701
H 2.728440 -1.422056 -1.607740
H 6.419706 -3.699237 -1.569175
H 2.649780 0.665408 -0.600006
H -3.523869 1.516883 2.774049
H -2.767669 0.499928 -1.387208
H 2.753780 -3.590491 -2.641874
H 4.316987 -4.041165 -3.374923
H 3.825661 -4.760086 -1.823763
H 8.604847 -1.170798 -0.859216
H 8.370410 -2.882982 -0.414970
H 8.159725 -1.596548 0.808521
H -1.160399 2.479852 2.955199
H -0.405196 1.446555 -1.189302
H -3.591620 -1.652254 1.356738
H 4.435309 5.503344 -1.262961
H 5.046134 4.423765 0.066000
H 3.815306 5.659002 0.415357
H -7.284446 -5.531313 1.286888


