%chk=000271189.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271189

0 1
O 2.473763 -1.911450 0.873086
O -4.186252 1.082511 1.205709
N 1.079113 0.771122 -0.536277
N -1.316594 1.497400 -0.461513
C -0.325629 0.510234 -1.011707
C 1.510066 2.185104 -0.762041
C -0.896382 2.918173 -0.685784
C 0.499821 3.119871 -0.085812
C 2.003827 -0.204714 -1.211516
C -2.674881 1.272347 -1.068303
C 3.337024 -0.232014 -0.509669
C -3.250133 -0.045911 -0.619528
C 3.547534 -1.093331 0.600430
C -3.996962 -0.133026 0.585465
C 4.397405 0.574665 -0.920251
C -3.076320 -1.211568 -1.365118
C 4.763804 -1.115687 1.292149
C -4.518411 -1.349722 1.040079
C 5.626231 0.554122 -0.243294
C -3.602586 -2.435893 -0.927273
C 5.800286 -0.279616 0.860177
C -4.310057 -2.501351 0.272255
C 2.525655 -2.720064 2.072602
C -4.822682 1.086407 2.505881
H -0.383572 0.442690 -2.125768
H -0.612342 -0.481917 -0.573135
H 1.623572 2.445235 -1.835410
H 2.508026 2.308350 -0.284117
H -1.629084 3.568538 -0.158480
H -0.903095 3.215148 -1.756106
H 0.466351 2.893857 1.002906
H 0.817068 4.171566 -0.186016
H 2.143894 0.002873 -2.295251
H 1.542011 -1.220946 -1.135915
H -2.674815 1.333066 -2.179181
H -3.340027 2.094804 -0.703445
H 4.272409 1.234447 -1.778636
H -2.521527 -1.174840 -2.302401
H 4.914706 -1.763281 2.148304
H -5.074793 -1.414259 1.968245
H 6.437692 1.192885 -0.580584
H -3.452569 -3.331205 -1.524235
H 6.750357 -0.288421 1.393064
H -4.710276 -3.453568 0.618407
H 2.640991 -2.084575 2.955586
H 3.321482 -3.465149 1.994732
H 1.534779 -3.193348 2.062214
H -4.784489 2.151856 2.767736
H -4.240302 0.491994 3.216160
H -5.854986 0.735993 2.425581


%chk=000271189-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271189

0 1
O 2.144597 -1.742855 0.888234
O -3.812696 0.979773 1.393900
N 1.062137 0.874008 -0.766198
N -1.301062 1.505451 -0.664702
C -0.286769 0.659491 -1.324466
C 1.478329 2.289605 -0.862753
C -0.959973 2.943246 -0.770398
C 0.437049 3.189686 -0.171702
C 2.049561 -0.069929 -1.354753
C -2.674819 1.211720 -1.156608
C 3.308863 -0.192246 -0.512964
C -3.208394 -0.116643 -0.647422
C 3.325988 -1.027353 0.644461
C -3.756883 -0.219479 0.666064
C 4.488086 0.510214 -0.842597
C -3.180096 -1.279798 -1.447201
C 4.484555 -1.121281 1.453833
C -4.229009 -1.459851 1.160564
C 5.656037 0.423230 -0.046755
C -3.651213 -2.526492 -0.969093
C 5.644521 -0.390387 1.105122
C -4.169525 -2.610328 0.339646
C 2.077867 -2.564823 2.096181
C -4.322326 0.923181 2.763661
H -0.290908 0.865094 -2.448385
H -0.560118 -0.399112 -1.174585
H 1.588916 2.607152 -1.937646
H 2.465450 2.402206 -0.381648
H -1.724845 3.523912 -0.223457
H -0.968238 3.291540 -1.839991
H 0.413764 2.950635 0.906249
H 0.718567 4.253099 -0.295400
H 2.336283 0.234816 -2.394907
H 1.559495 -1.058165 -1.417297
H -2.719077 1.219729 -2.277239
H -3.324516 2.026509 -0.791335
H 4.486762 1.137923 -1.742717
H -2.781757 -1.203259 -2.466989
H 4.497232 -1.757821 2.343718
H -4.646199 -1.540091 2.168973
H 6.556386 0.981732 -0.323320
H -3.613649 -3.413848 -1.609578
H 6.537699 -0.467255 1.735754
H -4.536846 -3.567256 0.727904
H 2.219252 -1.951341 3.007133
H 2.829700 -3.378820 2.076744
H 1.065220 -2.994188 2.093044
H -4.252434 1.955125 3.138293
H -3.703955 0.255821 3.394799
H -5.377909 0.587125 2.791832


