%chk=000188037.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188037

0 1
O 3.390277 1.243553 -0.486303
O 2.692654 0.406338 1.507997
O 3.611841 -1.424113 -0.650708
O 8.902065 -1.119797 0.192167
C -6.389604 -0.049896 -0.364153
C -5.127534 0.238566 0.459976
C -7.657771 0.071138 0.491645
C -3.859406 0.117379 -0.395842
C -8.920043 -0.217013 -0.332315
C -2.598027 0.406740 0.428877
C -10.188334 -0.096044 0.523349
C -1.330254 0.285168 -0.427369
C -11.450411 -0.383672 -0.300696
C -0.072805 0.574136 0.401324
C -12.719950 -0.263226 0.554136
C 1.189861 0.459057 -0.458028
C -13.979382 -0.548263 -0.261160
C 2.424955 0.630900 0.363082
C 4.738476 1.206330 -0.184072
C 5.463898 0.006031 -0.210491
C 6.860954 0.087606 0.000154
C 5.354660 2.458112 0.031885
C 4.807257 -1.302207 -0.468370
C 7.481714 1.313207 0.218107
C 6.725645 2.502132 0.230009
C 7.708523 -1.153186 -0.011861
C 5.693955 -2.508353 -0.504757
C 7.007966 -2.442929 -0.295090
H -6.328404 -1.064019 -0.804096
H -6.446933 0.647551 -1.221997
H -5.189607 1.252418 0.900409
H -5.071093 -0.459203 1.317809
H -7.601136 -0.626679 1.349296
H -7.719465 1.084945 0.932114
H -3.798196 -0.897244 -0.834945
H -3.917253 0.814245 -1.254190
H -8.977232 0.480596 -1.190017
H -8.858918 -1.230969 -0.772546
H -2.541863 -0.291095 1.287165
H -2.661154 1.420685 0.869383
H -10.131609 -0.794124 1.380725
H -10.249594 0.917690 0.963988
H -1.388159 0.981933 -1.286138
H -1.269574 -0.730405 -0.865791
H -11.390766 -1.397078 -0.741958
H -11.508800 0.313612 -1.158371
H -0.009074 -0.129658 1.257980
H -0.135180 1.585929 0.849194
H -12.781940 0.751007 0.994869
H -12.663911 -0.962247 1.411469
H 1.257193 -0.547445 -0.944172
H 1.172049 1.183245 -1.302351
H -13.967777 -1.560452 -0.681115
H -14.085693 0.151734 -1.097640
H -14.879698 -0.459914 0.356993
H 4.740098 3.358851 0.037902
H 8.563816 1.348950 0.381918
H 7.227152 3.456913 0.401368
H 5.170109 -3.447231 -0.711627
H 7.660031 -3.321736 -0.313922


%chk=000188037-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188037

0 1
O 3.605173 1.416281 -0.686146
O 2.737447 0.561256 1.321796
O 3.518266 -1.369541 -0.802542
O 8.818385 -1.619256 0.595354
C -6.430665 0.117709 -0.391420
C -5.141537 0.409814 0.409212
C -7.703338 0.088699 0.484683
C -3.869556 0.437162 -0.467901
C -8.989358 -0.224067 -0.313262
C -2.575368 0.688227 0.338200
C -10.262123 -0.255674 0.562869
C -1.305350 0.719590 -0.541332
C -11.546986 -0.577382 -0.233453
C -0.009023 0.897268 0.279053
C -12.819415 -0.611078 0.643902
C 1.242194 0.948193 -0.620669
C -14.097614 -0.935073 -0.159696
C 2.537630 0.914100 0.151024
C 4.948203 1.198591 -0.314438
C 5.518203 -0.103164 -0.194920
C 6.911276 -0.191085 0.133036
C 5.733811 2.358974 -0.139728
C 4.744719 -1.354981 -0.454566
C 7.689355 0.972810 0.319940
C 7.102978 2.247666 0.174822
C 7.588922 -1.521436 0.281092
C 5.458840 -2.652042 -0.309956
C 6.775855 -2.737033 0.039910
H -6.323425 -0.856820 -0.912607
H -6.550830 0.882936 -1.186873
H -5.247216 1.382792 0.933357
H -5.022052 -0.358028 1.202187
H -7.577587 -0.668206 1.287188
H -7.818505 1.067066 0.996809
H -3.779305 -0.527352 -1.010404
H -3.977748 1.221724 -1.246087
H -9.116171 0.532140 -1.116259
H -8.873076 -1.202631 -0.824869
H -2.465926 -0.103279 1.108733
H -2.664940 1.647520 0.889538
H -10.132843 -1.008417 1.368775
H -10.381882 0.724469 1.070679
H -1.395305 1.539464 -1.284698
H -1.241536 -0.223382 -1.123883
H -11.428228 -1.557452 -0.741689
H -11.678824 0.175295 -1.039011
H 0.095770 0.063700 0.999076
H -0.072214 1.824210 0.882756
H -12.938053 0.368577 1.150625
H -12.685869 -1.362488 1.448946
H 1.273543 0.064867 -1.290229
H 1.238135 1.834423 -1.281258
H -14.016324 -1.923071 -0.651330
H -14.268836 -0.181092 -0.951277
H -14.992603 -0.953096 0.489321
H 5.248998 3.333505 -0.248703
H 8.747275 0.851617 0.572287
H 7.704542 3.151443 0.313477
H 4.845807 -3.540308 -0.499561
H 7.292898 -3.696156 0.153318


