%chk=000269666.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269666

0 1
O 0.097640 -1.839683 -0.664303
O 1.260131 2.550297 0.656104
O 4.666065 -0.727102 0.207870
O -3.908221 -0.695586 -0.895246
O -1.948244 -2.482443 -1.094300
O -3.477857 1.426405 -0.228866
C 0.653411 0.402683 0.005213
C 1.026988 -0.939872 -0.306839
C 1.711311 1.296958 0.377561
C -0.711864 0.770827 -0.068611
C -1.674266 -0.142910 -0.434672
C 2.356068 -1.384586 -0.258492
C 3.335928 -0.460906 0.111740
C 3.034062 0.887955 0.434616
C -1.347112 -1.510352 -0.758920
C -3.074259 0.311102 -0.489381
C -5.342268 -0.404016 -0.975144
C 2.226790 3.563984 1.048229
C 5.125651 -2.073515 -0.095585
C -5.944795 -0.396717 0.413609
H -0.998624 1.808046 0.172746
H 2.574046 -2.418184 -0.507453
H 3.848190 1.548390 0.713665
H -5.476995 0.554779 -1.505640
H -5.680962 -1.254753 -1.595851
H 1.577426 4.437385 1.200550
H 2.940204 3.737014 0.236930
H 2.722313 3.271183 1.978710
H -7.038872 -0.346120 0.376850
H -5.668951 -1.299500 0.974860
H -5.591131 0.468032 0.995351
H 4.898613 -2.323469 -1.136471
H 4.682949 -2.788948 0.604159
H 6.208036 -1.978676 0.063813


%chk=000269666-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269666

0 1
O 0.146018 -1.921404 -0.648292
O 1.244433 2.596359 0.627740
O 4.765083 -0.692366 0.225466
O -3.998635 -0.697181 -0.908553
O -2.003900 -2.614459 -1.076172
O -3.403398 1.440720 -0.197499
C 0.682017 0.365604 -0.004876
C 1.088759 -0.971161 -0.293263
C 1.705648 1.311674 0.359587
C -0.703637 0.687668 -0.094038
C -1.677444 -0.245237 -0.451988
C 2.433798 -1.387627 -0.234590
C 3.402167 -0.426464 0.126828
C 3.049396 0.923045 0.425457
C -1.319418 -1.635760 -0.756807
C -3.084089 0.257278 -0.495921
C -5.431782 -0.269356 -0.952008
C 2.228599 3.617418 1.007933
C 5.224961 -2.057685 -0.067290
C -6.086941 -0.453674 0.419639
H -1.034490 1.707918 0.124883
H 2.675158 -2.425794 -0.468204
H 3.852369 1.610670 0.697159
H -5.478032 0.782845 -1.283406
H -5.869193 -0.934721 -1.712909
H 1.641093 4.532184 1.168814
H 2.964327 3.778357 0.197615
H 2.750905 3.334460 1.941109
H -7.166821 -0.224745 0.351265
H -5.974555 -1.494106 0.769188
H -5.637483 0.225780 1.163205
H 4.987508 -2.340219 -1.109808
H 4.774454 -2.785809 0.632619
H 6.314525 -2.026511 0.073920


