%chk=000194630.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194630

0 1
O -5.363414 1.011721 -0.209958
O 0.260591 -1.525860 1.479991
O 1.014871 -0.120950 -2.566347
O 2.720389 1.233937 -2.077201
C -2.265640 -0.832207 -0.440288
C -3.476805 -0.410606 0.442802
C -1.822521 -2.282370 -0.219306
C -3.109698 0.396752 1.693949
C -2.717303 -0.537965 -1.859429
C -4.395481 0.366922 -0.521696
C -0.360562 -2.501315 -0.623232
C -3.869847 0.143629 -1.902804
C 0.614488 -1.948391 0.402260
C -2.175682 1.533975 1.398739
C 2.064459 -1.963728 -0.034994
C 2.949154 -1.107336 0.878398
C -0.873838 1.484469 1.697106
C 4.296392 -0.783564 0.225242
C 0.105492 2.559247 1.330013
C 5.222848 -0.039075 1.197325
C 1.173715 2.016959 0.368382
C 6.552883 0.321761 0.539939
C 0.547217 1.518227 -0.939135
C 1.570816 0.942298 -1.859343
H -1.389054 -0.154038 -0.215599
H -4.043246 -1.317344 0.768493
H -1.939228 -2.537446 0.857948
H -2.477758 -2.979563 -0.774222
H -4.043151 0.790677 2.155076
H -2.665737 -0.291319 2.445211
H -2.111167 -0.856748 -2.694693
H -0.160214 -2.035787 -1.613649
H -0.165501 -3.583762 -0.761585
H -4.407624 0.511391 -2.760321
H -2.634946 2.388947 0.903996
H 2.433536 -3.009661 -0.046170
H 2.147243 -1.615438 -1.085298
H 2.414531 -0.158684 1.134376
H 3.095149 -1.624741 1.846759
H 4.788626 -1.711240 -0.122231
H 4.138243 -0.164395 -0.683645
H -0.430955 0.614638 2.196860
H -0.401078 3.437657 0.882118
H 0.597510 2.941974 2.249582
H 5.405466 -0.659826 2.096229
H 4.725614 0.881994 1.560223
H 1.733587 1.179577 0.858134
H 1.927302 2.800853 0.154651
H 7.206077 0.859506 1.236059
H 6.406500 0.965717 -0.335891
H 7.093765 -0.569601 0.203421
H 0.017651 2.348299 -1.458901
H -0.256510 0.762335 -0.717338
H 1.630341 -0.480900 -3.256408


%chk=000194630-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194630

0 1
O -5.614358 0.370730 -0.879640
O 0.520468 -0.945804 1.278186
O 2.401991 1.198494 -1.744954
O 3.186204 2.446278 0.046234
C -2.318231 -1.139841 -0.232201
C -3.674415 -0.634997 0.342117
C -1.783361 -2.426599 0.451772
C -3.595810 0.500043 1.402499
C -2.587656 -1.271169 -1.724927
C -4.520107 -0.257276 -0.900329
C -0.364465 -2.835901 0.006805
C -3.803529 -0.770184 -2.097113
C 0.740640 -1.863139 0.439561
C -2.884937 1.746246 0.914130
C 2.109607 -2.049414 -0.213941
C 3.280547 -1.423214 0.570284
C -1.747348 2.251668 1.460470
C 4.610496 -1.446005 -0.214674
C -1.037824 3.513001 1.007794
C 5.754615 -0.713229 0.523096
C 0.479527 3.303818 0.753313
C 7.089325 -0.744073 -0.251919
C 0.743014 2.284440 -0.370194
C 2.212099 2.030573 -0.618767
H -1.560736 -0.343013 -0.077409
H -4.199660 -1.494132 0.813913
H -1.768061 -2.247352 1.543452
H -2.483576 -3.263945 0.263384
H -4.638801 0.755637 1.678124
H -3.094575 0.116137 2.311394
H -1.853636 -1.699832 -2.417765
H -0.297886 -2.981521 -1.090759
H -0.103918 -3.824983 0.440992
H -4.214931 -0.710672 -3.107752
H -3.351635 2.267528 0.063149
H 2.280095 -3.126691 -0.412627
H 2.038977 -1.565854 -1.214368
H 3.019787 -0.382541 0.836277
H 3.408894 -1.958297 1.532136
H 4.913204 -2.494523 -0.419201
H 4.460766 -0.975347 -1.212184
H -1.286496 1.722577 2.311246
H -1.526068 3.912125 0.096422
H -1.144407 4.292825 1.790594
H 5.895563 -1.175142 1.521366
H 5.450363 0.336947 0.705670
H 0.969098 2.953087 1.681333
H 0.949619 4.272386 0.499036
H 7.887147 -0.213840 0.299325
H 6.987204 -0.259544 -1.241905
H 7.428695 -1.783688 -0.421489
H 0.275779 2.600058 -1.322996
H 0.280627 1.312033 -0.110582
H 3.379572 1.044734 -1.862780


