%chk=000221017.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221017

0 1
O 0.004120 0.703240 1.463398
C 0.000738 0.020706 0.183704
C -1.259199 0.448969 -0.605205
C 1.263992 0.437779 -0.605889
C -0.005750 -1.455836 0.617263
C -2.551367 0.248313 0.194913
C 2.554816 0.225006 0.193255
C -0.009791 -2.441483 -0.554098
C -3.755919 0.887150 -0.507298
C 3.764574 0.853582 -0.509277
C -5.049090 0.667657 0.290737
C 5.056344 0.621422 0.287443
C -0.017156 -3.888700 -0.065755
C -6.254133 1.304079 -0.398375
C 6.266639 1.247242 -0.402175
H -1.310440 -0.118480 -1.553539
H -1.168849 1.511950 -0.899149
H 1.183107 1.501678 -0.899312
H 1.309412 -0.129658 -1.554513
H 0.869860 -1.636972 1.273519
H -0.883160 -1.629397 1.273156
H -2.733037 -0.833215 0.349839
H -2.424709 0.676876 1.210903
H 2.432657 0.653989 1.209621
H 2.726913 -0.858201 0.347285
H 0.877252 -2.270424 -1.196038
H -0.894292 -2.261791 -1.197186
H -3.868094 0.467166 -1.525060
H -3.583238 1.971307 -0.647223
H 3.601672 1.939432 -0.647847
H 3.872074 0.433739 -1.527591
H 0.008749 1.668544 1.346211
H -5.226899 -0.416920 0.428318
H -4.937036 1.086272 1.310265
H 4.949046 1.040183 1.307425
H 5.224221 -0.464870 0.423948
H -0.901672 -4.104496 0.544618
H 0.863591 -4.112644 0.547132
H -0.019185 -4.590637 -0.906925
H -6.127803 2.386429 -0.514231
H -6.416089 0.884336 -1.397576
H -7.171349 1.141052 0.178509
H 6.424249 0.826366 -1.401593
H 7.182689 1.075841 0.174134
H 6.149944 2.330717 -0.517637


%chk=000221017-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221017

0 1
O 0.014332 0.804841 1.634274
C 0.005597 0.102828 0.312776
C -1.262112 0.537952 -0.477263
C 1.275232 0.519611 -0.484245
C -0.004228 -1.390670 0.713182
C -2.610122 0.208720 0.199817
C 2.621500 0.180113 0.191422
C -0.027658 -2.392391 -0.463147
C -3.807663 0.889860 -0.500376
C 3.823297 0.857447 -0.505169
C -5.168214 0.549408 0.149619
C 5.180887 0.509690 0.147168
C -0.036804 -3.855977 0.029925
C -6.360469 1.236053 -0.551232
C 6.377420 1.195928 -0.546734
H -1.233536 0.086417 -1.489713
H -1.199905 1.637509 -0.636132
H 1.224222 1.618862 -0.648967
H 1.238506 0.062670 -1.493985
H 0.883153 -1.583090 1.345107
H -0.881405 -1.564954 1.364425
H -2.773261 -0.888001 0.203505
H -2.566203 0.524595 1.260886
H 2.578829 0.492625 1.253551
H 2.778615 -0.917482 0.191436
H 0.854596 -2.232554 -1.114658
H -0.921459 -2.214219 -1.093713
H -3.830758 0.594510 -1.570963
H -3.663222 1.991121 -0.486802
H 3.683599 1.959310 -0.489031
H 3.847362 0.564758 -1.576446
H 0.021806 1.781924 1.458787
H -5.312925 -0.550348 0.135938
H -5.143761 0.845285 1.218213
H 5.154062 0.800824 1.217020
H 5.322227 -0.590437 0.129004
H -0.924260 -4.054957 0.659951
H 0.859913 -4.072679 0.640675
H -0.053013 -4.569830 -0.814082
H -6.254336 2.337235 -0.525903
H -6.425167 0.930921 -1.612960
H -7.320180 0.978106 -0.066626
H 6.444489 0.895817 -1.609735
H 7.334808 0.932647 -0.060401
H 6.274613 2.297302 -0.516294


