%chk=000106721.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000106721

0 1
O -6.059508 0.100533 0.130547
O -0.573562 0.518289 -0.148384
O -0.253610 0.957011 -2.360829
C 7.973966 -0.141369 0.393281
C 6.488864 -0.209441 0.016388
C 8.666785 -1.492820 0.173601
C -8.339448 -0.333844 -0.398899
C 5.792278 1.143631 0.235270
C -8.478985 -1.312669 0.784285
C 10.153850 -1.429559 0.549882
C -6.909268 -0.354313 -0.969906
C 4.339085 1.057085 -0.139185
C -8.722635 1.087857 0.021457
C -8.521158 -2.771607 0.339309
C 10.848049 -2.772162 0.332866
C 3.931122 1.333503 -1.455714
C 3.381810 0.690753 0.821698
C 1.630587 0.885706 -0.839856
C 2.585396 1.248968 -1.806057
C 2.033942 0.605957 0.475235
C -4.705681 0.174953 -0.092272
C 0.215192 0.809676 -1.258647
C -4.054117 -0.150040 -1.288183
C -3.995886 0.631007 1.044546
C -1.971851 0.423616 -0.234512
C -2.661569 -0.024442 -1.359864
C -2.617729 0.761420 0.970688
H 8.480374 0.641730 -0.203655
H 8.082234 0.168748 1.450685
H 6.378733 -0.519459 -1.041546
H 5.980410 -0.992181 0.613237
H 8.561095 -1.805312 -0.883243
H 8.162967 -2.278122 0.769577
H -9.024231 -0.661174 -1.222498
H 5.904673 1.460018 1.292732
H 6.301586 1.931325 -0.357337
H -7.634376 -1.153888 1.487373
H -9.395965 -1.073720 1.356944
H 10.660691 -0.646461 -0.047434
H 10.261994 -1.120161 1.607936
H -6.787999 0.345815 -1.812735
H -6.591689 -1.370509 -1.257017
H -8.692136 1.782198 -0.824676
H -9.730558 1.127273 0.446295
H -8.024138 1.471642 0.778780
H -8.642252 -3.439633 1.200512
H -7.596959 -3.068535 -0.169527
H -9.355032 -2.966202 -0.343990
H 11.908474 -2.718036 0.603777
H 10.394952 -3.564348 0.939785
H 10.793404 -3.090931 -0.714332
H 4.669207 1.612673 -2.206199
H 3.692634 0.469690 1.841622
H 2.261895 1.462717 -2.828947
H 1.285390 0.321991 1.220525
H -4.601049 -0.493399 -2.160343
H -4.544847 0.873449 1.952177
H -2.131477 -0.258850 -2.285729
H -2.031626 1.111747 1.818706


%chk=000106721-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106721

0 1
O -6.156854 0.058983 0.302277
O -0.589233 0.768506 -0.212439
O -0.192072 0.859950 -2.532178
C 8.072906 -0.168025 0.315735
C 6.559693 -0.184707 0.005596
C 8.699600 -1.580320 0.328925
C -8.477810 -0.358800 -0.318172
C 5.925990 1.236170 -0.009550
C -8.606510 -1.546161 0.674504
C 10.216109 -1.575571 0.630185
C -7.045058 -0.186443 -0.851110
C 4.442994 1.195690 -0.336417
C -8.996342 0.954714 0.313447
C -8.228186 -2.922628 0.085706
C 10.831316 -2.991476 0.641240
C 3.995036 1.217740 -1.684667
C 3.470447 1.077479 0.692252
C 1.664541 0.991058 -0.960010
C 2.626867 1.116768 -1.996798
C 2.097995 0.976183 0.391679
C -4.790255 0.235650 0.050053
C 0.233461 0.872424 -1.351438
C -4.200400 0.238826 -1.237673
C -3.976043 0.421804 1.197369
C -2.007570 0.600323 -0.237080
C -2.805980 0.422552 -1.388777
C -2.591702 0.601811 1.052920
H 8.595692 0.459291 -0.436642
H 8.243104 0.319138 1.298916
H 6.386676 -0.667395 -0.977508
H 6.031707 -0.808458 0.754839
H 8.524305 -2.069028 -0.652438
H 8.179629 -2.206394 1.083914
H -9.099821 -0.590200 -1.211052
H 6.087492 1.708039 0.979398
H 6.464117 1.854257 -0.754923
H -7.975999 -1.334531 1.558853
H -9.655745 -1.578102 1.030421
H 10.735419 -0.950935 -0.125199
H 10.391630 -1.087280 1.610690
H -6.993090 0.678393 -1.545374
H -6.702188 -1.094516 -1.387445
H -8.966819 1.790895 -0.410288
H -10.040699 0.838195 0.656336
H -8.376146 1.236210 1.182768
H -8.432647 -3.729744 0.812763
H -7.154043 -2.977421 -0.169004
H -8.808156 -3.142622 -0.831396
H 11.914843 -2.961157 0.858729
H 10.350148 -3.626750 1.408796
H 10.696856 -3.490019 -0.337415
H 4.729809 1.316837 -2.492860
H 3.797055 1.066177 1.739276
H 2.277727 1.132831 -3.034598
H 1.355755 0.885009 1.188994
H -4.807668 0.101982 -2.136817
H -4.446774 0.418680 2.184791
H -2.354180 0.431685 -2.380648
H -1.948632 0.742228 1.926740


