%chk=000281581.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281581

0 1
S 8.595441 -0.118166 -0.431174
F 8.810791 1.695552 -0.791778
O 0.001418 -1.106064 0.225708
O 2.211939 0.118523 2.591460
O 9.358309 -0.382723 0.954262
O 8.986183 -0.880321 -1.788037
N -4.783032 0.171231 -0.045549
N -5.887826 2.360029 -0.416390
N -6.421412 0.965720 1.534788
N -5.307985 -1.032732 1.949746
N -7.188502 3.161684 1.365706
N 2.581620 -0.089879 0.271250
C -5.309038 1.189129 -1.093270
C -4.159839 1.685227 -1.994448
C -6.398767 0.476393 -1.936733
C -3.711527 -0.744640 -0.336497
C -5.523477 0.059290 1.131667
C -2.397629 -0.426921 0.098458
C -6.462419 2.147750 0.764665
C -3.953167 -1.952086 -1.037877
C -1.338626 -1.322737 -0.168474
C -2.879387 -2.838711 -1.293361
C -1.574991 -2.537676 -0.858011
C 0.299637 0.105093 1.012779
C 1.781453 0.034686 1.407268
C 3.994042 -0.103210 0.174425
C 6.754946 -0.115537 -0.188044
C 4.548954 -0.310062 -1.122122
C 4.854911 0.095481 1.293437
C 5.939295 -0.315799 -1.315687
C 6.249350 0.091735 1.105935
H -4.583499 2.434072 -2.683113
H -3.384185 2.184641 -1.390567
H -3.702414 0.876004 -2.587420
H -6.831127 1.207260 -2.640967
H -5.981826 -0.371848 -2.513092
H -7.201842 0.116005 -1.271799
H -2.246831 0.512357 0.638741
H -4.966796 -2.188084 -1.376292
H -3.063408 -3.773862 -1.832576
H -5.817117 -1.052281 2.830231
H -4.740230 -1.822351 1.656417
H -0.735723 -3.214754 -1.042853
H -7.291306 4.049222 0.882065
H -7.528513 3.027247 2.313457
H -0.290153 0.210129 1.940476
H 0.148715 0.983483 0.347422
H 2.076718 -0.275232 -0.602884
H 3.888728 -0.458818 -1.984411
H 4.423368 0.264287 2.279970
H 6.378523 -0.475118 -2.304862
H 6.925555 0.245986 1.952756


%chk=000281581-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281581

0 1
S 8.632875 -0.645863 0.022637
F 8.971183 0.544378 -1.367701
O 0.102596 -0.510711 -0.240571
O 2.210989 1.709168 1.704564
O 9.331204 -0.005813 1.320568
O 9.026085 -2.098291 -0.544602
N -4.802215 0.122324 -0.050189
N -6.179524 2.183367 -0.065461
N -6.345314 0.537108 1.749607
N -4.952847 -1.332172 1.825576
N -7.357653 2.631862 1.912498
N 2.612903 -0.078427 0.210038
C -5.534784 1.178214 -0.920289
C -4.507976 1.895602 -1.816510
C -6.607493 0.449163 -1.777394
C -3.651022 -0.590925 -0.536552
C -5.393705 -0.200809 1.167243
C -2.359708 -0.174015 -0.115697
C -6.602481 1.780058 1.126863
C -3.788067 -1.691126 -1.419244
C -1.220737 -0.855244 -0.596103
C -2.632593 -2.359089 -1.889937
C -1.346939 -1.948902 -1.486086
C 0.305685 0.614701 0.678621
C 1.809624 0.805108 0.919091
C 4.022062 -0.167704 0.200280
C 6.786079 -0.449306 0.092326
C 4.607842 -1.169928 -0.625513
C 4.849748 0.692518 0.978207
C 6.003051 -1.316271 -0.690492
C 6.248945 0.551931 0.918862
H -5.047266 2.665000 -2.392671
H -3.749494 2.405295 -1.198670
H -4.010209 1.204145 -2.518361
H -7.188780 1.201643 -2.337851
H -6.144230 -0.246303 -2.501203
H -7.304230 -0.108978 -1.126826
H -2.290569 0.676019 0.568652
H -4.786743 -2.014210 -1.727549
H -2.735427 -3.207681 -2.574417
H -5.357928 -1.514839 2.740296
H -4.339407 -2.009871 1.381234
H -0.446970 -2.457568 -1.844235
H -7.610885 3.546591 1.551020
H -7.605351 2.341230 2.853248
H -0.182228 0.424562 1.654148
H -0.101225 1.552755 0.253103
H 2.082662 -0.739039 -0.373245
H 3.969121 -1.832191 -1.220893
H 4.389756 1.454589 1.609552
H 6.467337 -2.083325 -1.317304
H 6.901556 1.199878 1.512132


