%chk=000197600.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197600

0 1
O 3.965620 1.309822 -1.286404
O 3.636583 2.116614 0.896483
O 0.676784 -1.452062 2.011600
O -2.860787 1.598200 1.854396
O -4.657719 0.563480 0.697547
O -4.083015 -1.208782 -1.796579
C 1.492541 -1.246469 -0.264043
C 2.822438 0.621580 -0.749693
C 0.623203 -0.332235 -1.206213
C 1.511478 0.914959 -1.532614
C 2.936188 -0.910989 -0.737158
C 2.786112 1.063201 0.711733
C 1.130582 -2.727632 -0.420925
C 1.342071 -0.812787 1.230800
C -0.779799 -0.082522 -0.711066
C 0.918365 2.282895 -1.251058
C 2.082010 0.407823 1.642659
C 4.317031 2.374025 -0.382829
C 2.207762 -3.643921 0.090004
C -1.042517 0.725622 0.421012
C -1.822320 -0.698776 -1.410647
C -2.364367 0.860310 0.792975
C -3.175978 -0.548630 -1.014932
C -3.434749 0.243084 0.096808
C 2.295681 -4.028878 1.361166
C -4.315497 1.405608 1.844619
C -5.475227 -1.100969 -1.386521
H 0.535168 -0.892547 -2.178186
H 1.767391 0.875273 -2.622789
H 3.164553 -1.330009 -1.729905
H 3.716465 -1.294177 -0.059839
H 0.911884 -2.961919 -1.481247
H 0.175528 -2.917130 0.126863
H 1.563443 3.080804 -1.637831
H -0.063617 2.394798 -1.732401
H 0.764535 2.473445 -0.180055
H 2.037767 0.679421 2.693069
H 3.939001 3.332568 -0.763944
H 5.397637 2.311133 -0.194215
H 2.917363 -3.981374 -0.665200
H -0.248698 1.213496 0.981973
H -1.626613 -1.322939 -2.281361
H 3.060098 -4.693505 1.733424
H 1.602988 -3.695814 2.128868
H -4.779871 2.388188 1.693105
H -4.586016 0.862072 2.759603
H -5.985405 -1.695216 -2.152044
H -5.790447 -0.052190 -1.404847
H -5.602426 -1.527849 -0.385959


%chk=000197600-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197600

0 1
O 4.078490 1.283244 -1.413448
O 3.777101 2.226363 0.743247
O 0.872076 -1.354820 2.218826
O -2.990551 1.607355 1.918509
O -4.769433 0.703235 0.613196
O -4.131070 -1.017077 -1.976885
C 1.567267 -1.230337 -0.153761
C 2.899600 0.616567 -0.794737
C 0.636670 -0.329186 -1.100206
C 1.537351 0.916756 -1.508848
C 2.969078 -0.916301 -0.766079
C 2.952697 1.115521 0.636985
C 1.162973 -2.727161 -0.216696
C 1.530391 -0.733509 1.331272
C -0.791393 -0.067769 -0.636157
C 0.963220 2.327914 -1.289406
C 2.295839 0.486149 1.654380
C 4.336293 2.477930 -0.632383
C 2.232121 -3.681887 0.282807
C -1.105797 0.692466 0.532007
C -1.843879 -0.607472 -1.412613
C -2.453676 0.845582 0.841899
C -3.220773 -0.436974 -1.089684
C -3.505386 0.304756 0.070391
C 2.163250 -4.385041 1.440249
C -4.422163 1.238554 1.956060
C -5.561224 -1.016809 -1.617994
H 0.542918 -0.940990 -2.018673
H 1.758236 0.815113 -2.589988
H 3.050681 -1.327682 -1.789992
H 3.806707 -1.289451 -0.156002
H 0.925237 -2.972445 -1.272831
H 0.241232 -2.858139 0.376425
H 1.617115 3.087000 -1.757732
H -0.031989 2.414391 -1.758540
H 0.845033 2.580474 -0.221937
H 2.336990 0.822597 2.693461
H 3.815912 3.369156 -1.030500
H 5.422357 2.626684 -0.537479
H 3.114345 -3.807135 -0.365938
H -0.338737 1.127024 1.174401
H -1.623904 -1.199176 -2.307526
H 2.963459 -5.069213 1.746370
H 1.311282 -4.270495 2.120212
H -5.023822 2.138758 2.146084
H -4.572733 0.441856 2.711783
H -6.057585 -1.533493 -2.452762
H -5.947778 0.011709 -1.517258
H -5.730826 -1.565492 -0.674306


