%chk=000185952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185952

0 1
O -0.340970 -2.510741 -0.081548
O 0.244209 2.077786 0.068584
N 0.340901 -0.269943 -0.007987
C 1.818539 -0.489980 -0.014592
C 2.440902 0.164187 -1.263763
C 2.439436 0.078796 1.276414
C 3.958900 -0.055375 -1.267547
C 3.957440 -0.140590 1.267189
C 4.602825 0.479321 0.019600
C -1.968520 -0.650488 -0.022168
C -1.793330 0.686462 0.023236
C -0.623662 -1.342824 -0.044464
C -0.313483 1.012860 0.034678
C -3.280889 -1.337237 -0.055787
C -2.885215 1.686730 0.066123
C -4.401976 -0.354715 0.337508
C -4.224068 1.025756 -0.317775
H 1.976083 -1.603090 -0.051898
H 2.214715 1.250850 -1.272292
H 1.989622 -0.252016 -2.182306
H 1.987123 -0.398194 2.164393
H 2.213245 1.162431 1.357638
H 4.404381 0.445557 -2.147680
H 4.184886 -1.133115 -1.382587
H 4.183318 -1.223638 1.309839
H 4.401897 0.300065 2.179493
H 5.688638 0.271594 0.013241
H 4.500020 1.581607 0.056594
H -3.459344 -1.744607 -1.075528
H -3.282734 -2.219865 0.618377
H -2.945216 2.125180 1.086858
H -2.665207 2.541162 -0.608524
H -5.383414 -0.779569 0.055824
H -4.419688 -0.240829 1.439300
H -5.061236 1.688253 -0.029156
H -4.278727 0.921318 -1.419289


%chk=000185952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185952

0 1
O -0.320656 -2.506211 -0.094947
O 0.198261 2.166466 0.088372
N 0.339874 -0.218146 -0.004015
C 1.807472 -0.425015 -0.013207
C 2.462919 0.199487 -1.271177
C 2.465169 0.096986 1.289198
C 3.986859 -0.071062 -1.277694
C 3.989037 -0.173636 1.272023
C 4.657441 0.442040 0.019205
C -1.971651 -0.645027 -0.024498
C -1.815109 0.710594 0.033856
C -0.608336 -1.282346 -0.048861
C -0.340626 1.028850 0.047011
C -3.292720 -1.359097 -0.046582
C -2.940588 1.704294 0.061549
C -4.428360 -0.376066 0.349843
C -4.267891 1.005122 -0.340717
H 1.933189 -1.526299 -0.057386
H 2.275639 1.289910 -1.271492
H 1.992014 -0.220866 -2.180404
H 1.995322 -0.394175 2.162773
H 2.279119 1.184198 1.376834
H 4.445556 0.408336 -2.163699
H 4.167446 -1.161942 -1.374791
H 4.169925 -1.268678 1.281005
H 4.449075 0.233344 2.192857
H 5.738866 0.205074 0.008638
H 4.568558 1.546889 0.063860
H -3.473088 -1.771506 -1.060680
H -3.266282 -2.235003 0.629220
H -3.024666 2.140101 1.078399
H -2.716582 2.555952 -0.608627
H -5.409057 -0.815780 0.090775
H -4.417919 -0.233112 1.448710
H -5.124267 1.656189 -0.085750
H -4.284545 0.863232 -1.439604


