%chk=000196740.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196740

0 1
O 3.343090 -1.931567 0.271729
O 1.821196 -0.116855 2.068233
O 3.218637 2.281020 -0.041683
O 1.607236 1.253061 -1.825425
O -1.911991 0.334891 0.034017
O 0.852280 -2.425107 -1.296387
N 0.050915 -1.458013 0.600740
N -3.499520 -1.161928 -0.506271
C -1.305661 -2.002644 0.393681
C -1.816251 -2.665735 1.686689
C -2.900908 -3.713560 1.417407
C 2.550974 0.171600 0.859493
C -4.209927 -3.125265 0.880318
C 2.393337 -0.947473 -0.186886
C 2.070210 1.586805 0.448380
C -4.064774 -2.528936 -0.529124
C -2.236586 -0.846483 -0.020380
C 1.039122 -1.664358 -0.355293
C 0.934939 1.646678 -0.597547
C 0.389160 3.038642 -0.733984
C -0.905943 3.307733 -0.556482
C -1.557528 4.663481 -0.674577
C 3.808642 -2.837456 -0.754276
C -0.582294 5.803628 -0.986236
C -2.334980 4.959957 0.617207
H -1.260197 -2.761010 -0.444862
H -0.961766 -3.157033 2.201017
H -2.184802 -1.899193 2.396256
H -2.515276 -4.482477 0.717121
H -3.111508 -4.257573 2.361757
H 3.641732 0.237194 1.123869
H -4.595489 -2.356909 1.580219
H -4.982980 -3.919517 0.857347
H 2.679583 -0.553660 -1.200617
H 1.786229 2.148296 1.375087
H -5.058166 -2.486270 -1.029276
H -3.422221 -3.183798 -1.163970
H 0.167997 -0.760747 1.354870
H 0.130882 0.894091 -0.400717
H -4.132277 -0.393326 -0.722258
H 1.136162 3.794984 -0.973600
H 2.207186 -0.919503 2.493723
H 3.330579 2.096980 -1.012533
H -1.612546 2.502226 -0.299670
H -2.292294 4.597223 -1.522459
H 1.091714 1.546553 -2.603073
H 4.430164 -2.296024 -1.472238
H 4.399698 -3.558080 -0.178364
H 2.960904 -3.327614 -1.252880
H -1.107238 6.760952 -1.072811
H -0.052409 5.632091 -1.929369
H 0.171739 5.915824 -0.197952
H -3.081787 4.186298 0.826110
H -2.858798 5.919195 0.554191
H -1.663690 5.008413 1.482838


%chk=000196740-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196740

0 1
O 3.148517 -1.937930 0.871380
O 1.741210 0.230714 2.048847
O 3.144760 1.989627 -0.913770
O 0.887402 0.984134 -1.769087
O -2.080404 0.369823 0.751400
O 0.966471 -2.350465 -1.392609
N 0.036366 -1.335526 0.487319
N -3.642138 -1.155147 0.001578
C -1.285245 -1.919819 0.267163
C -1.572283 -3.094654 1.260019
C -2.590564 -4.136605 0.741941
C 2.532796 0.341116 0.797074
C -4.026878 -3.610772 0.521110
C 2.447499 -0.968370 -0.017008
C 2.147923 1.677674 0.118079
C -4.118018 -2.459284 -0.507246
C -2.354360 -0.809669 0.355483
C 1.074860 -1.574397 -0.386201
C 0.729600 1.750583 -0.487406
C 0.262981 3.157993 -0.762622
C -0.963580 3.595673 -0.367970
C -1.543272 4.987085 -0.561778
C 3.603043 -3.158124 0.191061
C -0.624955 5.953510 -1.339895
C -1.936721 5.583891 0.820143
H -1.262353 -2.339721 -0.759940
H -0.605083 -3.603721 1.425606
H -1.896585 -2.687596 2.238415
H -2.210303 -4.555296 -0.212878
H -2.626747 -4.979413 1.459325
H 3.604931 0.440622 1.060630
H -4.465504 -3.269725 1.479328
H -4.656443 -4.445752 0.154696
H 3.005136 -0.849461 -0.966709
H 2.241895 2.454358 0.896921
H -5.170848 -2.314039 -0.807635
H -3.557996 -2.736489 -1.423577
H 0.197852 -0.678394 1.266901
H -0.003283 1.238431 0.161063
H -4.322969 -0.397598 0.102958
H 0.963618 3.810008 -1.301198
H 2.149571 -0.507005 2.572663
H 2.761426 1.628053 -1.761894
H -1.611777 2.884811 0.171760
H -2.486272 4.866686 -1.141196
H 0.046190 1.044610 -2.283683
H 4.293556 -2.906416 -0.638985
H 4.136219 -3.743344 0.957469
H 2.754819 -3.738296 -0.217154
H -1.114667 6.936959 -1.462298
H -0.383484 5.565074 -2.346304
H 0.326251 6.114426 -0.798684
H -2.605574 4.902124 1.377076
H -2.456873 6.551668 0.694056
H -1.035212 5.753076 1.437357


