%chk=000255692.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255692

0 1
O -2.740581 -0.371454 -1.393339
O 4.259471 0.314206 -0.209147
O -6.782302 -0.967813 0.191613
O 4.373587 -1.695627 0.824397
C -2.539158 -0.553011 0.047170
C -3.410099 0.579681 -0.485261
C -1.132221 -0.250018 0.560445
C -0.594772 1.062875 -0.082969
C 0.801621 1.313443 0.494453
C 1.769142 0.158810 0.067360
C -2.881683 1.998465 -0.585932
C -1.576170 2.212169 0.190333
C -3.181450 -1.794115 0.642384
C -0.172096 -1.433864 0.311053
C -4.920411 0.454728 -0.486516
C 1.274968 -1.133001 0.736679
C 1.568869 2.593954 0.121489
C 3.117032 0.720037 0.612199
C -4.654983 -1.953207 0.264734
C -5.408368 -0.636811 0.479734
C 3.045679 2.251728 0.428066
C 1.870399 -0.027317 -1.451770
C 4.798877 -0.935307 -0.013371
C 5.923276 -1.125254 -0.997720
C 7.119779 -1.786941 -0.328395
H -1.211711 -0.090207 1.665545
H -0.526053 0.909917 -1.191532
H 0.711502 1.301063 1.611620
H -3.640431 2.724286 -0.236165
H -2.717878 2.223842 -1.662801
H -1.125173 3.177773 -0.106825
H -1.783735 2.295745 1.273517
H -3.072067 -1.768371 1.745281
H -2.624026 -2.691070 0.297089
H -0.198750 -1.703191 -0.764503
H -0.527805 -2.328016 0.856395
H -5.249223 0.195923 -1.519561
H -5.402882 1.419727 -0.250856
H 1.340964 -1.050450 1.837499
H 1.939256 -1.981019 0.474323
H 1.225266 3.464472 0.700040
H 1.432752 2.848074 -0.943225
H 3.326549 0.403757 1.651442
H -4.749328 -2.260888 -0.798664
H -5.131648 -2.760838 0.852086
H -5.355687 -0.293888 1.535926
H 3.711587 2.563738 -0.398108
H 3.404370 2.773897 1.328593
H 2.454874 -0.918684 -1.700902
H 0.879417 -0.139288 -1.911271
H 2.363025 0.826521 -1.930696
H -7.350159 -0.179383 0.236416
H 5.548719 -1.749185 -1.838844
H 6.210065 -0.150901 -1.450493
H 6.829610 -2.718232 0.180873
H 7.895332 -2.036805 -1.061995
H 7.575663 -1.134473 0.427009


%chk=000255692-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000255692

0 1
O -2.956677 -0.203266 -1.439010
O 4.321610 0.198852 -0.356061
O -6.899485 -1.087459 0.458569
O 4.638008 -1.321202 1.396196
C -2.599137 -0.522837 0.002865
C -3.531345 0.638426 -0.292967
C -1.132113 -0.248690 0.371230
C -0.644303 1.127763 -0.177959
C 0.814184 1.331695 0.266187
C 1.767481 0.218601 -0.282085
C -3.010705 2.081249 -0.285286
C -1.593402 2.240500 0.312210
C -3.184072 -1.842674 0.507080
C -0.192259 -1.415232 -0.054853
C -5.050541 0.468485 -0.142104
C 1.300128 -1.144116 0.279940
C 1.546422 2.661188 -0.066027
C 3.104284 0.761321 0.299320
C -4.684924 -2.016129 0.193171
C -5.468902 -0.786660 0.654965
C 3.066942 2.295679 0.052963
C 1.841349 0.177880 -1.831278
C 4.989144 -0.849096 0.290246
C 6.167841 -1.318026 -0.550756
C 7.260708 -2.005506 0.289889
H -1.095524 -0.179210 1.484083
H -0.696378 1.099681 -1.285261
H 0.828109 1.230309 1.377718
H -3.718812 2.723583 0.271793
H -3.014788 2.438031 -1.334354
H -1.196399 3.236557 0.038529
H -1.645017 2.208500 1.421048
H -3.014088 -1.898957 1.602576
H -2.624249 -2.682115 0.055396
H -0.318226 -1.597481 -1.139733
H -0.495285 -2.347738 0.457497
H -5.492365 0.388969 -1.154564
H -5.477199 1.371962 0.337043
H 1.436193 -1.147451 1.380902
H 1.923083 -1.969711 -0.116279
H 1.263865 3.474029 0.625308
H 1.298468 3.003334 -1.088230
H 3.165588 0.512318 1.375860
H -4.833725 -2.146170 -0.894085
H -5.080033 -2.914910 0.699933
H -5.270204 -0.614682 1.738279
H 3.615336 2.527207 -0.876864
H 3.566567 2.841978 0.871595
H 2.620052 -0.537813 -2.148665
H 0.885404 -0.140347 -2.278707
H 2.103152 1.159571 -2.263174
H -7.432831 -0.287269 0.699221
H 5.767238 -2.027842 -1.303347
H 6.561026 -0.456974 -1.118668
H 6.831443 -2.824446 0.891476
H 8.046234 -2.421165 -0.365352
H 7.733930 -1.292292 0.987483


