%chk=000191251.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191251

0 1
O -2.216309 -3.500060 -0.046215
O 2.274402 0.331750 -2.509573
O 4.415837 0.411437 -0.886756
N -1.929365 0.618533 0.688485
C -2.416333 0.178040 -0.665941
C -0.832272 -0.212641 1.275023
C -2.815637 -1.308745 -0.630470
C -3.644681 1.028292 -1.060382
C -1.204000 -1.710052 1.260612
C -1.656131 -2.170873 -0.129987
C -1.546257 2.071313 0.685949
C -3.307567 2.522840 -1.066978
C -2.758866 2.934144 0.303786
C 0.569656 -0.027513 0.697568
C 0.800639 0.080705 -0.683660
C 1.652220 0.012887 1.583600
C 2.103378 0.227163 -1.152411
C 2.970365 0.157215 1.122738
C 3.198286 0.264240 -0.244041
C 5.598870 0.468099 -0.055250
H -1.614213 0.317417 -1.447165
H -0.799326 0.106980 2.358926
H -3.691811 -1.462715 0.034442
H -3.141127 -1.650214 -1.630239
H -4.469725 0.838204 -0.344454
H -4.012593 0.710594 -2.052342
H -0.351912 -2.313020 1.620374
H -2.032706 -1.883836 1.979623
H -0.809657 -2.204050 -0.849842
H -0.697420 2.287143 0.000110
H -1.209209 2.338265 1.710881
H -4.208780 3.114753 -1.312005
H -2.568483 2.747433 -1.859250
H -2.471431 4.000895 0.304784
H -3.550041 2.820068 1.071917
H -1.553833 -4.135030 0.276177
H -0.025870 0.061568 -1.403270
H 1.482545 -0.069544 2.656264
H 3.789558 0.184040 1.835532
H 3.240376 0.430001 -2.739909
H 6.393125 0.585454 -0.803997
H 5.716419 -0.467197 0.499858
H 5.553178 1.335719 0.609486


%chk=000191251-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191251

0 1
O -2.430604 -3.573358 -0.145918
O 2.556892 -0.176901 -2.553495
O 4.555474 0.389628 -0.868663
N -1.879079 0.589217 0.619329
C -2.494552 0.200293 -0.682422
C -0.824095 -0.302525 1.186141
C -2.940781 -1.278879 -0.663946
C -3.718715 1.104586 -0.970964
C -1.301541 -1.782050 1.163367
C -1.826449 -2.224892 -0.213371
C -1.502526 2.023993 0.685427
C -3.360906 2.604266 -0.927141
C -2.715683 2.940370 0.434505
C 0.606016 -0.120056 0.627766
C 0.931701 -0.239499 -0.752481
C 1.647888 0.193303 1.535405
C 2.252923 -0.059032 -1.191961
C 2.986387 0.369374 1.105782
C 3.287855 0.242773 -0.261554
C 5.687142 0.710995 0.000963
H -1.772848 0.353442 -1.527918
H -0.751736 -0.022986 2.258020
H -3.788409 -1.395901 0.038716
H -3.296434 -1.567568 -1.670197
H -4.495002 0.890465 -0.209474
H -4.134904 0.828463 -1.959487
H -0.468750 -2.431778 1.497511
H -2.135446 -1.892778 1.883123
H -1.000245 -2.235859 -0.955136
H -0.703845 2.272669 -0.057908
H -1.078135 2.218541 1.689394
H -4.263396 3.221700 -1.097013
H -2.646895 2.842894 -1.742754
H -2.388018 3.997641 0.465828
H -3.457538 2.791602 1.243173
H -1.740044 -4.214027 0.162998
H 0.177198 -0.464734 -1.509243
H 1.413962 0.303236 2.601211
H 3.767256 0.606984 1.835051
H 3.530981 -0.015820 -2.670485
H 6.559253 0.781960 -0.665340
H 5.850637 -0.088070 0.749372
H 5.528310 1.678017 0.515786


