%chk=000257139.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257139

0 1
O 1.959169 0.449361 -2.968291
O 0.895402 -2.257776 0.863533
N 0.022952 0.652599 -1.847650
N -0.558026 -0.725546 0.042284
N -2.076115 0.939216 -0.771353
C 1.693037 -1.116259 -1.113620
C 3.032111 -0.729173 -0.447345
C 2.952606 0.579347 0.346825
C 1.831976 -2.368621 -2.021227
C 4.269373 0.865869 1.104259
C 1.297521 0.025928 -2.048447
C 0.672994 -1.430899 0.014023
C 2.432232 -3.581871 -1.324346
C 4.445316 -0.088917 2.290664
C 4.290401 2.323841 1.582945
C -0.869664 0.237529 -0.804370
C -3.166475 0.756746 0.152091
C -4.284542 1.593406 -0.062174
C -3.159278 -0.169534 1.203207
C -5.386238 1.488651 0.786086
C -4.275899 -0.255574 2.039776
C -5.387720 0.566266 1.838504
H 3.339355 -1.558359 0.228486
H 3.819419 -0.656652 -1.224902
H 2.733930 1.424199 -0.334410
H 2.114782 0.544481 1.070562
H 2.459139 -2.103057 -2.900582
H 0.831850 -2.631039 -2.423814
H 5.125118 0.717388 0.399041
H 3.498407 -3.449054 -1.108907
H 1.933654 -3.792512 -0.363262
H 2.332071 -4.480054 -1.944870
H 4.422885 -1.137203 1.971415
H 3.648426 0.035917 3.033023
H 5.398216 0.080779 2.802089
H 3.454919 2.540913 2.257420
H 5.213336 2.546441 2.129768
H 4.230786 3.024876 0.744154
H -0.216811 1.417112 -2.487233
H -2.223289 1.663329 -1.480015
H -4.300466 2.314753 -0.874747
H -2.298776 -0.827399 1.382798
H -6.251613 2.131483 0.625530
H -4.271507 -0.976681 2.858585
H -6.250865 0.490049 2.496097


%chk=000257139-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257139

0 1
O 2.026171 1.033881 -2.449675
O 1.065164 -1.409629 1.543838
N -0.101793 0.889783 -1.565563
N -0.683242 -0.480976 0.332432
N -2.327702 0.761169 -0.848782
C 1.620404 -0.718368 -0.744962
C 3.101572 -0.603950 -0.296136
C 3.414494 0.658142 0.538959
C 1.402079 -1.994411 -1.670875
C 4.912997 0.797054 0.922740
C 1.244002 0.470748 -1.639767
C 0.668077 -0.868941 0.477563
C 1.744819 -3.342737 -1.006668
C 5.394300 -0.360221 1.831919
C 5.159237 2.161140 1.611093
C -1.026731 0.342187 -0.643743
C -3.501500 0.509883 -0.072680
C -4.703242 1.109357 -0.539012
C -3.513557 -0.281717 1.105011
C -5.908348 0.923520 0.166298
C -4.729806 -0.452600 1.801205
C -5.928616 0.140782 1.344428
H 3.333493 -1.501919 0.299468
H 3.735540 -0.612712 -1.203861
H 3.120781 1.560152 -0.034758
H 2.811429 0.642142 1.469099
H 2.032397 -1.844507 -2.568802
H 0.347439 -2.012978 -2.011017
H 5.508009 0.772421 -0.015813
H 2.817883 -3.417287 -0.761274
H 1.173688 -3.500689 -0.075894
H 1.503075 -4.166789 -1.702843
H 5.330176 -1.340822 1.326856
H 4.777721 -0.413451 2.749686
H 6.447121 -0.209380 2.136006
H 4.581252 2.230635 2.553060
H 6.228180 2.297546 1.860236
H 4.850203 3.001092 0.960722
H -0.353837 1.665977 -2.186546
H -2.492933 1.334707 -1.679440
H -4.695269 1.722857 -1.450481
H -2.584381 -0.741321 1.446250
H -6.827814 1.390316 -0.202963
H -4.734655 -1.061906 2.711648
H -6.864177 -0.003879 1.894638


