%chk=000245789.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245789

0 1
O -3.137324 -1.596545 0.481024
O -2.677275 2.018790 1.536042
O 0.009335 0.977665 -1.252298
O -4.542178 1.861715 0.311774
N 1.077109 -0.144220 0.463802
C -1.370288 -0.092498 0.415089
C -2.594073 0.530492 -0.325738
C -1.678835 -1.630249 0.298437
C -3.440635 -0.746643 -0.683867
C -1.588819 -2.023236 -1.179992
C -2.665647 -1.485749 -1.778632
C -0.052117 0.318559 -0.232647
C -3.404187 1.497751 0.489189
C 2.448850 0.075524 0.096799
C 3.468630 -0.431147 0.947156
C 2.789235 0.767739 -1.076172
C 4.805227 -0.226979 0.585281
C 3.156195 -1.169785 2.210003
C 4.131559 0.956879 -1.410857
C 5.141083 0.460995 -0.584604
H -1.384998 0.211880 1.490264
H -2.255129 1.067166 -1.256564
H -1.247148 -2.287767 1.051724
H -4.523491 -0.629337 -0.764707
H -0.785761 -2.608833 -1.580795
H -2.983721 -1.511342 -2.802010
H 0.932704 -0.664547 1.330902
H -3.198800 2.681955 2.066687
H 2.006854 1.165816 -1.732833
H 5.599238 -0.609557 1.226243
H 2.598782 -2.095843 2.013468
H 4.068107 -1.469435 2.747758
H 2.578594 -0.551296 2.911308
H 4.385267 1.496092 -2.323092
H 6.186558 0.608792 -0.846643


%chk=000245789-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245789

0 1
O -3.192952 -1.749692 0.390067
O -2.269949 1.891325 1.729522
O 0.006102 0.582759 -1.568308
O -4.398329 1.739256 0.823545
N 1.119779 -0.150251 0.372267
C -1.317420 -0.337714 0.282518
C -2.565932 0.458133 -0.212326
C -1.766856 -1.837009 -0.042888
C -3.560721 -0.706589 -0.622947
C -1.893399 -1.999999 -1.560455
C -3.010835 -1.310127 -1.915753
C -0.014469 0.091041 -0.399616
C -3.198165 1.390413 0.802638
C 2.492808 0.072439 0.053733
C 3.459635 -0.229104 1.065698
C 2.903330 0.570775 -1.210614
C 4.825658 -0.020099 0.769255
C 3.039878 -0.757093 2.428688
C 4.275596 0.767602 -1.471723
C 5.244132 0.473749 -0.487294
H -1.231591 -0.255727 1.379073
H -2.285855 1.064932 -1.096426
H -1.242935 -2.616623 0.524358
H -4.625078 -0.457252 -0.550635
H -1.167361 -2.498548 -2.203355
H -3.401836 -1.115728 -2.915334
H 0.940214 -0.508381 1.312596
H -2.732743 2.535115 2.332539
H 2.146465 0.800753 -1.962220
H 5.572003 -0.248326 1.539561
H 2.505240 -1.726466 2.359195
H 3.922774 -0.925358 3.066652
H 2.383342 -0.045842 2.969964
H 4.583111 1.153531 -2.449824
H 6.309261 0.626910 -0.690652


