%chk=000244981.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244981

0 1
O -1.187400 0.850708 -0.338204
O 5.282563 1.331810 0.139893
O -7.497552 0.433541 0.174972
O 6.781281 -0.657545 -0.557762
O 0.987520 1.340812 -0.590322
C 0.268906 -0.892057 0.285443
C -1.939824 -0.245514 0.151694
C 2.751457 -1.397156 0.223481
C -3.374630 -0.034193 0.142853
C -1.129763 -1.267344 0.528458
C 1.338458 -1.680828 0.486974
C 3.291034 -0.099121 0.351661
C 0.206553 0.499260 -0.253939
C 4.633864 0.129252 0.072670
C 3.581637 -2.462273 -0.149266
C -4.242874 -1.035247 0.632529
C -3.909793 1.168577 -0.354058
C 5.468666 -0.966675 -0.313152
C 4.941674 -2.250615 -0.419535
C -5.615548 -0.840598 0.626219
C -5.287082 1.384799 -0.369689
C -6.128386 0.375947 0.121533
C 4.450352 2.533579 0.301862
C 5.446635 3.656734 0.098050
C -8.150565 1.631912 -0.314360
H -1.417048 -2.217104 0.936276
H 1.153940 -2.693678 0.881332
H 2.646512 0.723891 0.661870
H 3.178076 -3.469129 -0.245175
H -3.830410 -1.968802 1.019072
H -3.229654 1.939894 -0.731666
H 5.572028 -3.085373 -0.713836
H -6.303982 -1.596810 0.998046
H -5.683692 2.317796 -0.756556
H 3.648891 2.521562 -0.458992
H 4.023724 2.514053 1.318603
H 4.972950 4.636845 0.221514
H 6.280197 3.583896 0.810906
H 5.892300 3.614944 -0.906136
H 7.297001 -1.461066 -0.823484
H -7.942210 1.769955 -1.379187
H -7.847448 2.498884 0.279590
H -9.209359 1.391576 -0.148283


%chk=000244981-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244981

0 1
O -1.269576 1.094186 -0.008738
O 5.487821 1.295787 -0.045882
O -7.691964 0.262910 0.091916
O 7.008768 -0.904046 0.067319
O 0.977602 1.688232 -0.058168
C 0.228564 -0.722413 0.085239
C -2.010568 -0.131198 0.066680
C 2.780398 -1.331813 0.106208
C -3.460149 -0.004487 0.070897
C -1.145373 -1.203734 0.121766
C 1.346184 -1.557521 0.125613
C 3.406181 -0.045752 0.032948
C 0.136936 0.765108 0.000377
C 4.806031 0.083390 0.021157
C 3.619104 -2.488366 0.166399
C -4.299294 -1.157028 0.148688
C -4.074629 1.275229 -0.001945
C 5.625815 -1.090270 0.082070
C 5.018274 -2.365335 0.153876
C -5.693860 -1.032186 0.153087
C -5.477045 1.412377 0.001824
C -6.292408 0.254968 0.079690
C 4.666675 2.530715 -0.109602
C 5.644396 3.699115 -0.168852
C -8.366363 1.563075 0.021134
H -1.432067 -2.252635 0.183891
H 1.082659 -2.625568 0.186746
H 2.768921 0.839823 -0.013811
H 3.164294 -3.483831 0.223341
H -3.853242 -2.155844 0.206827
H -3.437703 2.162674 -0.061424
H 5.650049 -3.261949 0.200588
H -6.345527 -1.908911 0.212819
H -5.917239 2.412110 -0.055716
H 4.018000 2.491618 -1.007084
H 4.017169 2.584151 0.786595
H 5.086880 4.652111 -0.216686
H 6.289899 3.713817 0.725867
H 6.289883 3.624297 -1.060585
H 7.477652 -1.775433 0.113269
H -8.120947 2.091575 -0.920229
H -8.100580 2.200307 0.886584
H -9.440620 1.329847 0.047210


