%chk=000244915.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244915

0 1
O -4.208928 0.795680 -0.197542
O 5.632256 0.007619 -0.785534
O -6.114122 -0.227800 -0.488269
C 1.454429 1.010934 0.507131
C 2.314983 -0.215260 0.059184
C 0.045056 0.937137 -0.095063
C -0.634288 -0.352819 0.461638
C -2.077898 -0.489684 -0.112145
C 1.672305 -1.474494 0.670292
C 0.216931 -1.611830 0.189995
C 3.709987 0.173035 0.649910
C 2.350507 2.218613 0.190333
C -0.776249 2.195264 0.242257
C -2.839170 0.798863 0.306153
C 3.783608 1.714337 0.479034
C -2.221072 2.078695 -0.253753
C 2.425107 -0.358142 -1.465720
C -2.841005 -1.653611 0.564369
C -2.071939 -0.672709 -1.634117
C 4.865670 -0.544612 -0.028580
C -4.313761 -1.687916 0.154770
C -4.952436 -0.363903 -0.180119
C 5.021392 -2.000683 0.320441
H 1.344434 0.969982 1.621882
H 0.115257 0.852095 -1.208747
H -0.717014 -0.238164 1.571217
H 1.703229 -1.426410 1.774423
H 2.250252 -2.377891 0.392276
H 0.210891 -1.843537 -0.893197
H -0.246439 -2.484746 0.687631
H 3.733327 -0.076219 1.735432
H 2.095578 3.094319 0.806068
H 2.246828 2.534599 -0.861373
H -0.298886 3.082891 -0.216501
H -0.763839 2.381770 1.333245
H -2.941759 0.857726 1.413773
H 4.469225 1.979079 -0.349978
H 4.199192 2.183528 1.384089
H -2.821071 2.956071 0.058410
H -2.267926 2.077339 -1.360299
H 2.914909 -1.293515 -1.753766
H 1.439802 -0.342507 -1.946646
H 3.008488 0.461343 -1.906364
H -2.758541 -1.568547 1.665810
H -2.367081 -2.621118 0.308089
H -1.808519 -1.695526 -1.920345
H -3.054478 -0.449451 -2.070014
H -1.352420 0.000633 -2.118575
H -4.921151 -2.175139 0.949120
H -4.443469 -2.343143 -0.737816
H 5.467029 -2.122784 1.315960
H 4.060715 -2.535592 0.319128
H 5.690975 -2.506800 -0.390497


%chk=000244915-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244915

0 1
O -4.317636 0.830459 0.019424
O 5.637627 -0.230979 -0.831615
O -6.338256 -0.222894 0.057647
C 1.477258 0.972628 0.373490
C 2.347685 -0.244839 -0.086381
C 0.036225 0.944010 -0.178438
C -0.649129 -0.382547 0.296145
C -2.148567 -0.482869 -0.173636
C 1.665795 -1.539829 0.418673
C 0.196892 -1.631346 -0.077267
C 3.711310 0.143011 0.627406
C 2.375493 2.201202 0.096410
C -0.774194 2.185690 0.271915
C -2.855068 0.796840 0.353921
C 3.821946 1.688847 0.410960
C -2.257147 2.106275 -0.158953
C 2.553560 -0.299023 -1.623637
C -2.874106 -1.665452 0.530726
C -2.274779 -0.618893 -1.714418
C 4.928597 -0.638905 0.129616
C -4.387722 -1.686768 0.215177
C -5.097105 -0.330509 0.124531
C 5.256462 -1.942229 0.850076
H 1.387789 0.881093 1.482100
H 0.080029 0.953457 -1.287447
H -0.673211 -0.331485 1.411864
H 1.675960 -1.548585 1.529626
H 2.215362 -2.440632 0.079745
H 0.190245 -1.772198 -1.174816
H -0.262959 -2.538806 0.357714
H 3.576605 -0.086163 1.704972
H 2.100228 3.070430 0.719332
H 2.289057 2.518209 -0.960350
H -0.315251 3.102892 -0.141273
H -0.717039 2.273552 1.378268
H -2.794656 0.784790 1.464551
H 4.519264 1.891561 -0.420191
H 4.237639 2.173582 1.312285
H -2.832507 2.954890 0.253258
H -2.350090 2.155004 -1.259747
H 3.122060 -1.203888 -1.906211
H 1.594064 -0.329028 -2.167311
H 3.127513 0.566610 -1.994192
H -2.721257 -1.570408 1.625174
H -2.436250 -2.634525 0.229571
H -1.996910 -1.637233 -2.040859
H -3.308270 -0.428177 -2.053211
H -1.623716 0.092538 -2.250281
H -4.945529 -2.292958 0.950856
H -4.568225 -2.168940 -0.765627
H 5.676989 -1.711559 1.849063
H 4.347481 -2.547444 1.018873
H 5.999345 -2.521463 0.279592


