%chk=000222297.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222297

0 1
O -5.618920 1.140675 -0.826472
O 1.484889 -4.909257 0.273182
C 2.081870 1.516124 1.133690
C 3.888501 2.178780 -0.660018
C 2.468850 2.398835 -0.071282
C 0.545254 1.351972 1.216797
C -0.036282 0.554650 0.028976
C 2.594710 2.099893 2.456952
C 4.969807 2.725186 0.290036
C 3.972088 2.950537 -1.997352
C 4.149563 0.686251 -0.933269
C -1.535451 0.725752 -0.118024
C 0.323772 -0.914111 0.131681
C -2.375814 0.975046 0.970937
C -0.364865 -1.774586 0.994649
C -2.099361 0.612226 -1.406963
C 1.379638 -1.423474 -0.648429
C -3.758324 1.126483 0.800876
C -0.024269 -3.128518 1.089085
C -3.465441 0.756012 -1.605296
C 1.740028 -2.763381 -0.575531
C -4.287099 1.016573 -0.487617
C 1.025699 -3.607763 0.299168
C -6.562679 1.409920 0.236707
C 0.817426 -5.876124 1.117551
H 2.532726 0.499799 1.004760
H 2.353728 3.464297 0.200424
H 1.730633 2.224683 -0.884241
H 0.069774 2.350654 1.257070
H 0.285502 0.848832 2.167125
H 0.440437 0.976538 -0.903599
H 3.688945 2.218931 2.429073
H 2.165179 3.084768 2.664346
H 2.357314 1.447285 3.302787
H 5.975962 2.513723 -0.083024
H 4.883214 2.274936 1.289740
H 4.884391 3.808911 0.413907
H 4.972971 2.877818 -2.434241
H 3.266467 2.557785 -2.735003
H 3.753002 4.013882 -1.862743
H 4.228083 0.117539 0.001057
H 3.338010 0.234978 -1.520296
H 5.081862 0.536073 -1.485327
H -1.963521 1.055831 1.976778
H -1.186178 -1.391616 1.601333
H -1.453990 0.402411 -2.260775
H 1.936012 -0.754705 -1.314737
H -4.388208 1.323468 1.660521
H -0.573579 -3.777490 1.761205
H -3.914472 0.671372 -2.591892
H 2.551537 -3.172385 -1.171736
H -6.337235 2.368737 0.711952
H -7.512113 1.457175 -0.312402
H -6.568117 0.587781 0.957817
H 0.929061 -5.602573 2.170452
H -0.233439 -5.971595 0.829763
H 1.372352 -6.795241 0.889072


%chk=000222297-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222297

0 1
O -5.696328 0.970543 -0.977860
O 1.399415 -5.117854 0.449448
C 2.123853 1.495304 1.136056
C 3.899388 2.378394 -0.682434
C 2.546512 2.567588 0.082889
C 0.576076 1.328303 1.153652
C -0.000469 0.486508 -0.021462
C 2.604016 1.867040 2.562002
C 5.104016 2.215722 0.281375
C 4.126654 3.643634 -1.555496
C 3.826360 1.138152 -1.613423
C -1.517000 0.664041 -0.213479
C 0.354506 -1.004068 0.126661
C -2.374107 1.173498 0.789007
C -0.186067 -1.781629 1.179319
C -2.108460 0.270565 -1.446622
C 1.225811 -1.647904 -0.790341
C -3.770580 1.294447 0.584780
C 0.131747 -3.149394 1.331077
C -3.489730 0.384256 -1.672631
C 1.553687 -3.011341 -0.661148
C -4.330087 0.897862 -0.652136
C 1.009674 -3.767216 0.404832
C -6.604354 1.492201 0.044012
C 0.854737 -5.939970 1.530673
H 2.568482 0.516236 0.863816
H 2.567572 3.556312 0.589448
H 1.755370 2.643660 -0.692977
H 0.117908 2.338969 1.138279
H 0.276327 0.858779 2.112287
H 0.486680 0.841629 -0.953476
H 3.688937 2.061838 2.598037
H 2.087279 2.781091 2.915811
H 2.379617 1.054424 3.278709
H 6.047755 2.149449 -0.293286
H 5.018143 1.296692 0.889220
H 5.186492 3.078613 0.969032
H 5.051719 3.549158 -2.155458
H 3.283151 3.803175 -2.254301
H 4.221125 4.548873 -0.925882
H 3.683363 0.205299 -1.038252
H 2.989322 1.231950 -2.332852
H 4.761955 1.033365 -2.194983
H -1.961651 1.493226 1.751895
H -0.885131 -1.318761 1.886480
H -1.470374 -0.139368 -2.239295
H 1.649038 -1.075306 -1.624449
H -4.397801 1.697161 1.386091
H -0.310253 -3.717215 2.155712
H -3.941837 0.083723 -2.622930
H 2.223739 -3.508602 -1.369226
H -6.354140 2.537711 0.311892
H -7.604103 1.457090 -0.413588
H -6.589870 0.864022 0.956541
H 1.157439 -5.553724 2.523945
H -0.250298 -5.997188 1.477970
H 1.284675 -6.940663 1.376236


