%chk=000215614.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215614

0 1
O 3.308123 0.572100 -0.121154
O 2.682548 3.423549 -0.260993
N -2.875582 0.243482 0.054016
C -1.549543 -0.372226 -0.305506
C -0.408484 0.628849 -0.256880
C -1.236123 -1.511289 0.696653
C -0.637476 2.013989 -0.239348
C -3.075074 1.543662 -0.664399
C -2.035916 2.551323 -0.157802
C 0.909535 0.117830 -0.225555
C 0.056718 -2.161190 0.298436
C 1.100989 -1.347405 -0.205712
C -3.997416 -0.710735 -0.263743
C 1.987695 1.022609 -0.175477
C 0.437340 2.907493 -0.256378
C 1.751723 2.415930 -0.233437
C 0.227051 -3.545908 0.386708
C 2.267947 -1.958042 -0.684855
C 1.413595 -4.136539 -0.061511
C 2.424881 -3.345499 -0.610674
C -5.237174 -0.240000 0.314983
C 3.715584 0.175005 1.219744
C 4.076155 3.082056 -0.475473
C -6.275135 0.137484 0.796278
H -1.570383 -0.801111 -1.347287
H -2.070485 -2.238358 0.737392
H -1.161531 -1.093351 1.724981
H -4.097672 1.918045 -0.433264
H -3.006241 1.444167 -1.769321
H -2.248713 2.795617 0.909457
H -2.136164 3.502911 -0.715997
H -4.130530 -0.883886 -1.360779
H -3.740988 -1.707377 0.187423
H 0.280386 3.984307 -0.276116
H -0.564965 -4.168871 0.796631
H 3.061664 -1.339295 -1.116305
H 1.541462 -5.215376 0.009162
H 3.337310 -3.806411 -0.983252
H 3.644786 1.027327 1.899967
H 4.753272 -0.136125 1.064479
H 3.099430 -0.659579 1.569086
H 4.498927 2.694155 0.454691
H 4.505450 4.054022 -0.744103
H 4.181871 2.351938 -1.285222
H -7.164247 0.457726 1.211258


%chk=000215614-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215614

0 1
O 3.373221 0.399163 0.080073
O 2.916718 3.206835 0.201091
N -2.879650 0.227297 0.052781
C -1.562906 -0.417374 -0.218612
C -0.384886 0.559970 -0.101697
C -1.279188 -1.595323 0.746187
C -0.585680 1.956443 0.005910
C -2.996268 1.558711 -0.598090
C -1.992636 2.527275 0.035723
C 0.938838 0.001996 -0.089306
C 0.000569 -2.286519 0.311457
C 1.095376 -1.481448 -0.135579
C -4.001199 -0.666211 -0.356294
C 2.044869 0.894207 0.024147
C 0.531500 2.819853 0.081560
C 1.835763 2.300982 0.077293
C 0.112241 -3.694047 0.312261
C 2.269242 -2.132995 -0.606654
C 1.292772 -4.329234 -0.134717
C 2.366994 -3.540636 -0.605285
C -5.328841 -0.159093 0.037679
C 4.015885 0.556418 1.407380
C 3.846550 3.233333 -0.951302
C -6.460385 0.226839 0.337128
H -1.550093 -0.832249 -1.265699
H -2.107792 -2.324421 0.756478
H -1.192548 -1.181477 1.770756
H -4.026779 1.922630 -0.445021
H -2.820402 1.490160 -1.702629
H -2.297315 2.710736 1.084526
H -2.021742 3.501054 -0.488966
H -4.003435 -0.836076 -1.465492
H -3.857660 -1.655872 0.112420
H 0.401664 3.905721 0.141567
H -0.735915 -4.296823 0.659499
H 3.104381 -1.528420 -0.964058
H 1.366981 -5.422526 -0.129568
H 3.280628 -4.019975 -0.974511
H 4.049294 1.622618 1.695092
H 5.034771 0.156004 1.290931
H 3.465219 -0.029011 2.166995
H 4.288140 2.235969 -1.123578
H 4.626612 3.961237 -0.680166
H 3.314451 3.574194 -1.860146
H -7.442761 0.567087 0.609241


