%chk=000278406.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278406

0 1
O 1.581463 0.952490 0.989844
O 1.120092 3.456934 -0.958645
O 2.788374 -1.156872 -1.163024
O 2.077185 -2.811249 0.541508
N -0.368241 0.377226 -0.186133
N -1.105688 -1.666928 -0.953907
N -2.353018 0.969362 1.237214
N -4.102703 -0.743389 1.168143
N -3.904211 -2.746957 -0.072029
C 2.727340 1.538448 -1.063990
C 2.839843 0.783933 0.282687
C 1.259967 2.043300 -1.127912
C 0.558471 1.478312 0.139202
C 3.181339 -0.718043 0.148897
C 3.752927 2.658001 -1.169493
C 2.481997 -1.605016 1.206904
C -1.630794 0.167853 0.390708
C -0.104351 -0.785664 -0.987924
C -2.080389 -1.106106 -0.107205
C -3.368942 -1.547793 0.318128
C -3.563856 0.449319 1.575774
H 2.892119 0.818323 -1.909862
H 3.562934 1.259809 0.986035
H 0.761484 1.755165 -2.077192
H 0.031719 2.259507 0.752932
H 4.289400 -0.844528 0.195169
H 4.773526 2.281767 -1.024737
H 3.730772 3.135730 -2.155951
H 3.577045 3.440288 -0.415749
H 3.182760 -1.943294 1.990436
H 1.612773 -1.104458 1.674694
H 1.537252 3.937052 -1.704140
H 0.836158 -0.883480 -1.536395
H 2.760704 -2.162519 -1.166309
H 1.125091 -2.748900 0.282373
H -4.191672 1.051364 2.256052
H -3.412602 -3.332697 -0.728927
H -4.831568 -3.014889 0.218023


%chk=000278406-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278406

0 1
O 1.595034 0.338548 1.126075
O 1.304285 3.278733 0.254476
O 2.829794 -1.498715 -0.933456
O 4.452638 -2.706805 0.845293
N -0.570456 0.121686 0.121636
N -1.495782 -1.722643 -0.884326
N -2.646492 1.213226 0.957758
N -4.659679 -0.076851 0.370553
N -4.579805 -2.100296 -0.851016
C 2.224961 1.313121 -1.007205
C 2.782411 0.635031 0.268516
C 0.967802 2.039806 -0.461142
C 0.432779 1.075668 0.628125
C 3.568397 -0.656472 0.018232
C 3.233269 2.222140 -1.729185
C 3.817676 -1.452338 1.307656
C -1.954440 0.231051 0.310746
C -0.351590 -1.070860 -0.596315
C -2.505445 -0.914986 -0.323959
C -3.924060 -1.043856 -0.275272
C -3.992619 0.974355 0.941445
H 1.889931 0.517375 -1.698541
H 3.424619 1.345370 0.828823
H 0.208822 2.227506 -1.244539
H -0.037973 1.645690 1.446596
H 4.550191 -0.379756 -0.426654
H 4.083280 1.632933 -2.116720
H 2.767620 2.726612 -2.596377
H 3.640926 2.994586 -1.051169
H 4.491668 -0.892915 1.986340
H 2.853042 -1.650870 1.810308
H 1.547813 3.977886 -0.401527
H 0.657584 -1.409720 -0.835753
H 3.227203 -2.408214 -0.850892
H 4.453333 -3.376370 1.571683
H -4.620001 1.715126 1.446240
H -4.047954 -2.825707 -1.326814
H -5.594083 -2.147676 -0.784438


