%chk=000272023.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272023

0 1
O -2.753667 0.523386 0.054250
O -1.314166 -1.557892 2.150659
O -1.837372 3.496335 0.544429
N 0.137708 2.434351 0.201275
C -1.475219 -0.150069 0.239281
C -1.791688 1.121254 0.975287
C -1.532886 -1.485871 0.965974
C -1.858461 -2.690114 0.115373
C -1.209385 2.456860 0.549444
C -0.969373 -2.814723 -1.129218
C 0.470208 -2.527863 -0.816312
C 1.204576 -1.648199 -1.503535
C 2.632407 -1.329542 -1.169182
C 2.838546 0.154442 -1.058387
C 3.281106 0.749660 0.053769
C 3.533745 2.215337 0.161538
H -0.830415 -0.136367 -0.649279
H -2.104784 1.092719 2.030542
H -1.770743 -3.604918 0.742180
H -2.928145 -2.638299 -0.185206
H -1.351757 -2.152192 -1.933622
H -1.057366 -3.845929 -1.537030
H 0.873900 -3.086678 0.029623
H 0.716507 1.610093 0.233467
H 0.599790 3.294772 -0.053348
H 0.804416 -1.101886 -2.359421
H 3.295917 -1.731413 -1.969884
H 2.955751 -1.851191 -0.243292
H 2.614767 0.715778 -1.965582
H 3.506879 0.183031 0.959625
H 3.187321 2.782867 -0.711296
H 4.613904 2.412150 0.256133
H 3.057679 2.643810 1.054542


%chk=000272023-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272023

0 1
O -2.106669 0.846310 1.750333
O -1.168408 -1.853868 2.286910
O -2.197808 2.270115 -0.880697
N 0.131309 2.350889 -0.766466
C -2.120752 -0.250600 0.733282
C -1.040417 0.809042 0.702671
C -1.730528 -1.643259 1.181210
C -1.973855 -2.752342 0.160773
C -1.107557 1.875832 -0.376315
C -1.127729 -2.536441 -1.138673
C 0.347123 -2.335368 -0.845356
C 1.120016 -1.356149 -1.382863
C 2.598193 -1.156032 -1.074096
C 2.963382 0.301545 -0.828857
C 3.298946 0.830284 0.379662
C 3.707147 2.267710 0.625385
H -2.922238 -0.147634 -0.010665
H -0.051762 0.529367 1.091315
H -1.701808 -3.710270 0.637759
H -3.046924 -2.790390 -0.112331
H -1.517653 -1.677352 -1.716728
H -1.273551 -3.435322 -1.771548
H 0.797813 -3.042625 -0.130945
H 1.002414 1.956441 -0.402588
H 0.167654 3.065997 -1.493095
H 0.669339 -0.646337 -2.094990
H 3.200442 -1.524100 -1.932518
H 2.880299 -1.772354 -0.200104
H 2.969748 0.954375 -1.717756
H 3.301814 0.167257 1.259029
H 3.676361 2.867733 -0.302185
H 4.738584 2.317880 1.024268
H 3.056772 2.753365 1.378979


