%chk=000189704.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189704

0 1
O -5.008784 1.029861 -0.490130
O 0.985216 -3.063640 -0.318577
O 3.574824 2.719652 -0.068947
O 4.776922 0.398383 -0.678660
C -1.572259 -0.485504 -0.367861
C -0.835576 0.626099 0.446632
C -3.132878 -0.442531 -0.330692
C -1.393426 2.006244 0.015479
C -3.580484 1.006017 -0.705576
C -2.913115 2.086769 0.151822
C -1.036142 -1.866183 0.025432
C 0.661454 0.527589 0.121479
C -0.942175 0.465989 1.971587
C -3.687677 -1.382849 -1.421538
C -3.733348 -0.851278 1.018096
C 1.247286 -0.715999 -0.160885
C 0.456761 -1.978556 -0.171149
C 1.472721 1.676276 0.157134
C 2.628108 -0.827507 -0.436281
C 2.835056 1.571853 -0.111706
C 3.419198 0.307327 -0.417781
C 5.494291 -0.849185 -0.844045
H -1.288701 -0.311119 -1.442269
H -1.097324 2.215058 -1.031995
H -0.928734 2.808193 0.623056
H -3.404229 1.200545 -1.787424
H -3.221292 1.968176 1.209780
H -3.268426 3.090088 -0.147713
H -1.543012 -2.665931 -0.556663
H -1.276076 -2.099215 1.084955
H -0.468832 -0.458649 2.320165
H -0.455052 1.295990 2.495275
H -1.994830 0.438281 2.296159
H -3.261327 -1.180336 -2.407763
H -3.496545 -2.434942 -1.187832
H -4.777606 -1.260231 -1.503191
H -4.820803 -0.676076 1.014613
H -3.569612 -1.909213 1.238147
H -3.318686 -0.262965 1.848831
H 1.063706 2.656857 0.400988
H -5.373482 1.900929 -0.726669
H 3.037794 -1.817563 -0.654586
H 4.539201 2.533368 -0.264070
H 6.524222 -0.497699 -0.985571
H 5.131665 -1.376014 -1.732145
H 5.405110 -1.462558 0.057690


%chk=000189704-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189704

0 1
O -5.084827 1.055395 -0.626985
O 1.030599 -3.111701 -0.325588
O 3.648517 2.747913 -0.151320
O 4.843576 0.409004 -0.630910
C -1.599607 -0.481495 -0.320335
C -0.843212 0.644370 0.490302
C -3.178432 -0.448899 -0.319919
C -1.431284 2.031586 0.088686
C -3.610260 1.001544 -0.693670
C -2.970034 2.077760 0.198331
C -1.034196 -1.875286 0.033280
C 0.655259 0.549225 0.117405
C -0.907937 0.495373 2.045175
C -3.704593 -1.390671 -1.443877
C -3.837825 -0.895655 1.012412
C 1.263592 -0.717788 -0.141358
C 0.475763 -1.979825 -0.156844
C 1.480541 1.700739 0.110496
C 2.662501 -0.818194 -0.398105
C 2.858070 1.601394 -0.144776
C 3.455666 0.329008 -0.398736
C 5.552152 -0.848164 -0.890437
H -1.316862 -0.286060 -1.380895
H -1.134951 2.262247 -0.955386
H -1.001623 2.826067 0.728152
H -3.284654 1.187575 -1.745249
H -3.304970 1.941165 1.243570
H -3.324756 3.080498 -0.117896
H -1.491450 -2.672054 -0.578297
H -1.257261 -2.133957 1.087798
H -0.592003 -0.507284 2.380741
H -0.221121 1.226951 2.508770
H -1.918342 0.686544 2.440369
H -3.171468 -1.216817 -2.398658
H -3.586437 -2.455366 -1.175577
H -4.778689 -1.199251 -1.608212
H -4.934071 -0.889827 0.893182
H -3.527614 -1.922357 1.277914
H -3.596024 -0.237805 1.862444
H 1.077720 2.698430 0.300803
H -5.380348 1.968636 -0.869379
H 3.062909 -1.819948 -0.585172
H 4.586784 2.481507 -0.349615
H 6.605727 -0.568025 -1.033713
H 5.162187 -1.336058 -1.803366
H 5.456387 -1.536640 -0.029952


