%chk=000183340.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183340

0 1
O 2.023853 -2.323624 -0.021289
O -2.744852 0.127550 -0.356816
O 4.075966 -3.151390 0.358098
O -2.950991 -1.095004 1.532007
C -0.359352 0.658362 -0.343634
C 0.638378 1.702213 0.277881
C 0.029461 -0.793933 0.063979
C 2.400141 -0.019505 0.427135
C 2.113683 1.392797 -0.074879
C 1.474031 -0.998664 -0.344115
C -1.746603 1.002142 0.271139
C 0.193422 3.113570 -0.044166
C -0.419648 0.759904 -1.872982
C -2.223140 2.418887 -0.068663
C 3.731638 -0.698958 0.286298
C -1.110613 3.415915 -0.155726
C 3.398962 -2.172156 0.222334
C 1.241229 4.173332 -0.165543
C 4.958477 -0.197004 0.247919
C -3.276818 -0.906043 0.384946
C -4.259323 -1.665934 -0.496887
C -3.722111 -3.081895 -0.701107
C -5.628617 -1.654109 0.180525
H 0.552193 1.610091 1.397665
H -0.635179 -1.525078 -0.435571
H -0.122847 -0.969998 1.146437
H 2.150600 -0.054011 1.525833
H 2.290044 1.485637 -1.161445
H 2.791136 2.119071 0.410331
H 1.593355 -0.916163 -1.450499
H -1.756967 0.814752 1.369273
H 0.488848 0.379702 -2.351113
H -1.270809 0.184564 -2.262618
H -0.552802 1.795688 -2.207282
H -2.973044 2.749654 0.679442
H -2.770547 2.390933 -1.039513
H -1.444281 4.436385 -0.340145
H 1.906941 4.186832 0.708134
H 0.812013 5.181045 -0.251829
H 1.862497 4.016214 -1.058539
H 5.167863 0.863738 0.300152
H 5.846203 -0.816876 0.163694
H -4.330651 -1.148766 -1.490168
H -4.417039 -3.683911 -1.299090
H -3.580462 -3.605155 0.255502
H -2.756896 -3.082072 -1.221948
H -6.358485 -2.233795 -0.397300
H -6.023415 -0.636383 0.283681
H -5.586042 -2.094749 1.187063


%chk=000183340-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183340

0 1
O 2.028761 -2.366810 -0.060973
O -2.757922 0.068131 -0.534370
O 4.194392 -3.186486 0.289837
O -3.078156 -0.914052 1.566248
C -0.337301 0.695329 -0.514036
C 0.631814 1.698480 0.232473
C 0.024337 -0.786747 -0.141154
C 2.402235 -0.040182 0.357841
C 2.135752 1.410340 -0.070678
C 1.501193 -1.008756 -0.434776
C -1.756082 1.029118 0.032236
C 0.193131 3.158333 0.046452
C -0.306570 0.884154 -2.055141
C -2.222002 2.441133 -0.354347
C 3.742740 -0.732244 0.237045
C -1.112349 3.463903 -0.195433
C 3.433429 -2.213074 0.164369
C 1.230730 4.250960 0.227545
C 5.004353 -0.241561 0.207245
C -3.344177 -0.859004 0.343494
C -4.321305 -1.769545 -0.392611
C -3.786230 -3.226382 -0.354634
C -5.720194 -1.673646 0.268513
H 0.517256 1.478021 1.321441
H -0.603440 -1.479795 -0.729061
H -0.179298 -0.973321 0.930944
H 2.093877 -0.135279 1.424804
H 2.371792 1.557750 -1.141993
H 2.773889 2.107269 0.502671
H 1.704130 -0.903503 -1.518196
H -1.761307 0.898454 1.131554
H 0.663614 0.596704 -2.494289
H -1.087640 0.259018 -2.522873
H -0.489820 1.935059 -2.335108
H -3.092909 2.724160 0.268478
H -2.589139 2.431670 -1.400921
H -1.407621 4.518262 -0.286453
H 1.710208 4.192572 1.225227
H 0.772707 5.250517 0.132783
H 2.042753 4.177305 -0.521150
H 5.209019 0.833261 0.265032
H 5.858839 -0.922480 0.122172
H -4.379195 -1.425797 -1.440357
H -4.485122 -3.895891 -0.887103
H -3.694668 -3.574149 0.689434
H -2.795307 -3.311940 -0.836293
H -6.424347 -2.355031 -0.241554
H -6.128816 -0.648765 0.209570
H -5.660634 -1.961658 1.332698


