%chk=000196408.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196408

0 1
O -8.610536 -0.037317 -0.227693
O -7.746104 -2.019575 0.451479
C 3.551760 0.504482 -0.195901
C 2.217448 -0.221165 0.023770
C 4.744427 -0.404806 0.129747
C 1.024692 0.688015 -0.301857
C 6.078994 0.320452 -0.089788
C -0.308881 -0.038708 -0.081855
C 7.271724 -0.588768 0.235874
C -1.501865 0.870376 -0.407397
C 8.606102 0.136429 0.016493
C -2.831184 0.139653 -0.185905
C 9.800149 -0.772059 0.341902
C -4.027774 1.052446 -0.512889
C 11.131125 -0.055351 0.125192
C -5.281134 0.377289 -0.308520
C -6.330716 -0.194881 -0.135114
C -7.558271 -0.885031 0.074696
C -9.941974 -0.594426 -0.063939
H 3.621794 0.855388 -1.243580
H 3.592348 1.416353 0.430606
H 2.148673 -0.572474 1.071512
H 2.178126 -1.133394 -0.602490
H 4.675229 -0.755985 1.177410
H 4.704672 -1.316873 -0.496565
H 1.095067 1.038782 -1.349638
H 1.065583 1.599822 0.324855
H 6.148988 0.671423 -1.137421
H 6.119519 1.232376 0.536604
H -0.376782 -0.390443 0.966102
H -0.347325 -0.951324 -0.708108
H 7.231705 -1.500697 -0.390557
H 7.202146 -0.939879 1.283495
H -1.430564 1.220770 -1.455596
H -1.459984 1.782150 0.219897
H 8.677471 0.488025 -1.030661
H 8.647941 1.048463 0.642340
H -2.874579 -0.773711 -0.812484
H -2.904071 -0.212289 0.862687
H 9.760760 -1.684236 -0.285135
H 9.731270 -1.122907 1.390210
H -3.987990 1.975637 0.114758
H -3.958484 1.411352 -1.568443
H 11.219069 0.833418 0.760296
H 11.976839 -0.711226 0.359991
H 11.248664 0.272201 -0.913989
H -10.584907 0.241023 -0.360219
H -10.095909 -0.880117 0.981401
H -10.063651 -1.459783 -0.723073


%chk=000196408-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196408

0 1
O -8.857323 0.023758 -0.207994
O -7.864863 -1.990771 0.444206
C 3.592594 0.481876 -0.209884
C 2.236897 -0.230913 -0.004579
C 4.810943 -0.413113 0.109993
C 1.020105 0.667340 -0.321049
C 6.165848 0.302460 -0.091086
C -0.336028 -0.043790 -0.112592
C 7.385274 -0.589689 0.233217
C -1.550329 0.858231 -0.427381
C 8.739663 0.128562 0.038038
C -2.902364 0.143913 -0.213141
C 9.959448 -0.762737 0.365369
C -4.106737 1.073577 -0.534985
C 11.307726 -0.035129 0.172748
C -5.416203 0.438868 -0.335645
C -6.517883 -0.094704 -0.166261
C -7.753611 -0.799129 0.059356
C -10.177283 -0.621272 -0.001585
H 3.664608 0.837062 -1.259371
H 3.628436 1.390186 0.427801
H 2.166155 -0.587673 1.044355
H 2.199621 -1.137975 -0.643711
H 4.737846 -0.770155 1.158755
H 4.777575 -1.320427 -0.529150
H 1.090529 1.022688 -1.370534
H 1.059585 1.574990 0.317261
H 6.240527 0.657572 -1.140420
H 6.197492 1.211151 0.546299
H -0.405634 -0.399837 0.936326
H -0.376493 -0.950480 -0.751498
H 7.356444 -1.496868 -0.406471
H 7.308703 -0.947466 1.281546
H -1.481258 1.212082 -1.477549
H -1.507284 1.765802 0.210949
H 8.819032 0.485260 -1.010459
H 8.769081 1.036333 0.676904
H -2.959591 -0.757691 -0.852851
H -2.983969 -0.204592 0.834340
H 9.931390 -1.667848 -0.275530
H 9.877499 -1.121489 1.411870
H -4.049325 1.984090 0.096066
H -4.033047 1.423801 -1.584875
H 11.374672 0.854293 0.827631
H 12.162968 -0.694573 0.409813
H 11.425937 0.309518 -0.872068
H -10.909968 0.157648 -0.254456
H -10.285290 -0.945597 1.047282
H -10.282515 -1.498243 -0.662497


