%chk=000185942.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185942

0 1
O -6.092323 1.170746 -0.357280
O 4.970811 2.050397 -0.433192
O 5.759671 -0.639675 0.426419
O -4.258249 2.962130 0.463016
N -0.260912 -1.663639 -0.123335
C -0.634437 -0.288855 0.358957
C 0.286601 0.681960 -0.417264
C -1.287792 -2.685659 0.245441
C -2.100273 0.029542 0.128704
C 1.095582 -2.049121 0.383654
C -2.565248 -2.355041 -0.542943
C -3.018037 -0.947095 -0.282528
C 1.733078 0.349966 -0.194962
C 2.115095 -0.957255 0.166669
C -2.541806 1.342112 0.385081
C -4.377732 -0.622123 -0.469980
C 2.706962 1.344724 -0.358745
C 3.470370 -1.270654 0.338426
C -3.881386 1.666679 0.202558
C -4.806165 0.676264 -0.232642
C 4.057577 1.035472 -0.174182
C 4.441345 -0.280897 0.163548
C -7.102453 0.269175 -0.868683
C 5.802006 2.404100 0.706806
C 6.631733 -0.545886 -0.734319
H -0.439848 -0.172802 1.461926
H 0.066533 1.728942 -0.133244
H 0.062358 0.605238 -1.506212
H -1.504898 -2.722509 1.334545
H -0.913990 -3.689665 -0.048712
H 1.400812 -2.956569 -0.191325
H 1.095248 -2.331203 1.462395
H -3.357046 -3.087056 -0.295064
H -2.364623 -2.466166 -1.633177
H -1.853253 2.115954 0.724358
H -5.072369 -1.389922 -0.797097
H 2.432346 2.362480 -0.633638
H 3.789657 -2.276890 0.606199
H -5.231521 3.087900 0.288581
H -7.241941 -0.569545 -0.180373
H -6.836205 -0.067270 -1.875062
H -7.989559 0.915407 -0.889307
H 6.305422 1.518251 1.111153
H 5.181265 2.888153 1.465473
H 6.513896 3.108609 0.264673
H 6.587238 0.458923 -1.170089
H 6.343054 -1.307051 -1.463961
H 7.615508 -0.757875 -0.303669


%chk=000185942-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185942

0 1
O -6.172075 1.172536 -0.435894
O 5.087787 2.038016 -0.439435
O 5.852504 -0.688826 0.325417
O -4.416518 2.972696 0.501255
N -0.260360 -1.629949 -0.021051
C -0.647253 -0.257680 0.405652
C 0.285663 0.732152 -0.339442
C -1.285887 -2.656701 0.255243
C -2.126209 0.044760 0.149674
C 1.066298 -2.001706 0.512169
C -2.538533 -2.359795 -0.584080
C -3.025950 -0.941851 -0.327779
C 1.751596 0.371424 -0.153272
C 2.124194 -0.941866 0.236422
C -2.609411 1.350123 0.430713
C -4.390221 -0.606497 -0.540710
C 2.763564 1.340446 -0.358852
C 3.493871 -1.264051 0.382245
C -3.954460 1.680171 0.220021
C -4.851687 0.693251 -0.277713
C 4.126251 1.025127 -0.197947
C 4.498648 -0.305161 0.152239
C -7.173513 0.236054 -0.944018
C 5.902929 2.402182 0.742546
C 6.670224 -0.610425 -0.907501
H -0.464085 -0.135880 1.508658
H 0.108352 1.766290 0.009790
H 0.017600 0.700723 -1.413273
H -1.557003 -2.701611 1.341891
H -0.866537 -3.642387 -0.021122
H 1.369451 -2.959998 0.048022
H 1.022609 -2.183561 1.621257
H -3.337029 -3.089040 -0.345437
H -2.279675 -2.490486 -1.653251
H -1.948615 2.128539 0.824809
H -5.075265 -1.379706 -0.905458
H 2.504935 2.368198 -0.637991
H 3.808320 -2.275841 0.663445
H -5.387207 3.007829 0.290352
H -7.298723 -0.621952 -0.255684
H -6.896853 -0.131434 -1.950886
H -8.111297 0.808024 -1.000460
H 6.433239 1.520116 1.144812
H 5.258252 2.841792 1.527450
H 6.621184 3.155195 0.383313
H 6.658248 0.412520 -1.325187
H 6.290912 -1.326951 -1.660868
H 7.689838 -0.892107 -0.602487


