%chk=000192722.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192722

0 1
O 3.702994 -0.214293 1.751194
O 5.275643 -0.221983 -1.276023
O -6.296899 -0.195357 0.725639
C 2.118741 -0.280998 -0.157821
C 1.306557 0.979731 0.276424
C -0.123324 0.934833 -0.276166
C -0.829966 -0.326491 0.293814
C 3.550051 0.107075 0.358525
C 1.471497 -1.498839 0.516055
C -2.268958 -0.463659 -0.312742
C -0.002763 -1.616188 0.095353
C 2.217455 2.160458 -0.102440
C 3.649781 1.638160 0.142581
C -0.905210 2.197358 0.131501
C 2.185416 -0.474275 -1.677743
C -3.005104 0.869432 -0.220191
C -3.027650 -1.531126 0.521056
C -2.382719 2.041984 -0.034757
C -2.215361 -0.866055 -1.797708
C 4.695840 -0.680585 -0.318225
C -4.494556 0.847086 -0.425584
C -4.503535 -1.659182 0.151341
C -5.204394 -0.322760 0.220414
C 5.014109 -2.013580 0.274819
H 1.227726 0.968718 1.395264
H -0.098264 0.870342 -1.390120
H -0.947587 -0.168061 1.395446
H 1.559569 -1.418115 1.616666
H 2.011097 -2.426414 0.249748
H -0.047695 -1.927389 -0.968754
H -0.472440 -2.439675 0.667915
H 2.001256 3.057060 0.498117
H 2.078812 2.452665 -1.157529
H 4.308297 1.862067 -0.720407
H 4.122607 2.119988 1.013816
H -0.547586 3.061193 -0.465352
H -0.693093 2.460009 1.190249
H 1.186127 -0.448978 -2.129245
H 2.778041 0.310133 -2.167525
H 2.638631 -1.434517 -1.946037
H -2.943890 -1.278779 1.597944
H -2.535965 -2.516140 0.401014
H -2.938901 2.978516 0.017642
H -3.217368 -0.991951 -2.219436
H -1.703727 -0.100486 -2.393430
H -1.677343 -1.810156 -1.941217
H -4.962455 1.790444 -0.063245
H -4.709948 0.828737 -1.518271
H 3.117579 0.350600 2.297490
H -5.008587 -2.383675 0.824238
H -4.619927 -2.076645 -0.870014
H 5.137875 -1.934279 1.370454
H 4.200730 -2.732879 0.109421
H 5.935283 -2.438180 -0.146158


%chk=000192722-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192722

0 1
O 3.591045 -0.170307 1.855348
O 5.326424 -0.365972 -1.229845
O -6.290413 -0.051690 1.071997
C 2.166617 -0.294578 -0.246669
C 1.327910 0.951574 0.184029
C -0.132367 0.937066 -0.312610
C -0.834207 -0.374809 0.161619
C 3.574010 0.098676 0.397744
C 1.487556 -1.558233 0.326769
C -2.316973 -0.482872 -0.368726
C 0.011932 -1.645199 -0.147480
C 2.235751 2.155422 -0.167956
C 3.685874 1.631573 0.104398
C -0.898653 2.170604 0.218436
C 2.315117 -0.403848 -1.788202
C -3.040392 0.868993 -0.210852
C -3.073464 -1.539616 0.508301
C -2.397206 2.032719 0.075454
C -2.361138 -0.910203 -1.869356
C 4.755223 -0.720469 -0.163035
C -4.558469 0.867754 -0.392178
C -4.601048 -1.621110 0.246974
C -5.257110 -0.252770 0.382311
C 5.182948 -1.958923 0.600239
H 1.247876 0.908309 1.299872
H -0.143858 0.977461 -1.421372
H -0.908019 -0.291268 1.271070
H 1.534141 -1.531606 1.432981
H 2.021798 -2.474500 0.005751
H 0.002799 -1.843089 -1.235195
H -0.456183 -2.526384 0.331535
H 1.997519 3.051679 0.431300
H 2.110155 2.432421 -1.231535
H 4.346806 1.788861 -0.764530
H 4.158320 2.127351 0.971309
H -0.558278 3.083518 -0.310167
H -0.642504 2.334182 1.289578
H 1.332634 -0.404221 -2.289665
H 2.913931 0.418398 -2.213230
H 2.826437 -1.344256 -2.061620
H -2.913490 -1.289353 1.576326
H -2.634683 -2.540923 0.341224
H -2.992573 2.948067 0.208029
H -3.374914 -0.803109 -2.294036
H -1.686761 -0.281600 -2.478094
H -2.061780 -1.965862 -1.999911
H -4.998574 1.835815 -0.098960
H -4.806586 0.708891 -1.465325
H 2.904402 0.398900 2.285582
H -5.087807 -2.326106 0.942791
H -4.780966 -1.990080 -0.783852
H 5.632372 -1.656525 1.563784
H 4.311693 -2.584769 0.862021
H 5.913620 -2.529088 0.005625


