%chk=000183188.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183188

0 1
O 2.869985 0.662117 -2.227739
C 2.563694 0.639406 0.192242
C 1.239536 -0.103114 0.171825
C 2.758703 1.518962 -1.070585
C 2.762798 1.452994 1.483844
C 1.253246 -1.518714 0.150255
C 4.098233 2.268037 -1.049709
C 4.117297 2.172392 1.480386
C 0.055616 -2.251337 0.059228
C 4.267329 3.069208 0.243689
C 0.005003 0.582162 0.149847
C 2.569849 -2.248260 0.272541
C -1.211470 -0.155315 0.057574
C 0.048744 -3.756979 -0.038322
C -1.184519 -1.574095 0.007131
C 2.542769 -3.682440 -0.259651
C 1.363705 -4.433116 0.359806
C -2.483152 0.538286 0.005051
C -0.099053 2.032005 0.225557
C -2.448825 -2.286222 -0.095171
C -2.532832 1.958674 0.058029
C -3.699514 -0.190979 -0.103555
C -1.283471 2.684321 0.180748
C -3.636527 -1.638973 -0.149394
C -3.769319 2.620317 -0.002177
C -4.924266 0.494763 -0.161917
C -4.953909 1.889069 -0.112228
H 3.408763 -0.108742 0.147024
H 1.905949 2.210332 -1.238935
H 2.686363 0.779431 2.358215
H 1.947293 2.195436 1.605277
H 4.162998 2.928784 -1.935260
H 4.924263 1.538510 -1.172206
H 4.939994 1.432000 1.508189
H 4.222211 2.777385 2.400599
H 3.524608 3.889411 0.280422
H 5.259830 3.558828 0.251166
H 3.376196 -1.681476 -0.251146
H 2.856067 -2.256554 1.347524
H -0.770755 -4.174176 0.585294
H -0.197903 -4.027288 -1.089618
H 2.457550 -3.678064 -1.363911
H 3.496380 -4.191768 -0.027730
H 1.462564 -4.451737 1.462830
H 1.358977 -5.490032 0.034783
H 0.830386 2.601059 0.339691
H -2.418406 -3.376604 -0.123385
H 2.068657 0.109310 -2.322212
H -1.333958 3.771017 0.239949
H -4.576470 -2.184124 -0.226926
H -3.804483 3.707363 0.036886
H -5.853787 -0.065062 -0.246452
H -5.908738 2.411593 -0.159176


%chk=000183188-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183188

0 1
O 2.940301 0.676195 -2.234223
C 2.541118 0.720346 0.230007
C 1.211166 -0.045333 0.101445
C 2.927127 1.543003 -1.039425
C 2.691142 1.566710 1.533739
C 1.248081 -1.481523 0.037356
C 4.341729 2.125744 -0.908426
C 4.119894 2.152853 1.635886
C 0.045757 -2.245118 0.053952
C 4.483703 2.976006 0.376576
C -0.056158 0.629566 0.072376
C 2.603508 -2.197059 -0.075629
C -1.281327 -0.140808 0.028037
C 0.064996 -3.775458 0.097853
C -1.222596 -1.580557 0.037745
C 2.506938 -3.684023 -0.470757
C 1.448123 -4.384924 0.394296
C -2.562713 0.522279 -0.010507
C -0.184611 2.078061 0.059679
C -2.469283 -2.320775 0.002270
C -2.642899 1.961749 -0.016858
C -3.785188 -0.244084 -0.044169
C -1.410911 2.711690 0.015153
C -3.695331 -1.684181 -0.038343
C -3.912335 2.598738 -0.056094
C -5.037595 0.428274 -0.082246
C -5.099507 1.836915 -0.088163
H 3.344758 -0.032462 0.306120
H 2.207366 2.373248 -1.199205
H 2.477306 0.917267 2.404298
H 1.956294 2.390969 1.577713
H 4.570132 2.724752 -1.809321
H 5.062333 1.284014 -0.887494
H 4.850332 1.325067 1.749198
H 4.203372 2.781709 2.543308
H 3.819780 3.863435 0.313710
H 5.518281 3.360754 0.456490
H 3.229904 -1.669057 -0.818554
H 3.142041 -2.124591 0.893044
H -0.656927 -4.126067 0.860314
H -0.301898 -4.171532 -0.872972
H 2.225162 -3.775288 -1.539306
H 3.499229 -4.159365 -0.356652
H 1.701962 -4.248824 1.464868
H 1.424373 -5.473876 0.201473
H 0.713505 2.694826 0.074981
H -2.439652 -3.413379 -0.004546
H 2.031703 0.292193 -2.345747
H -1.464347 3.806814 0.000405
H -4.623187 -2.267728 -0.069602
H -3.959622 3.694060 -0.060862
H -5.959622 -0.164373 -0.106988
H -6.071509 2.341150 -0.118004


