%chk=000291624.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291624

0 1
O -4.538509 0.867669 -0.384715
O -0.881365 3.647985 0.160704
O -3.400009 -2.085413 0.910080
O 1.721577 -3.542336 0.030497
O 5.117783 1.680468 0.206801
O 3.322370 2.758034 0.967591
N -0.168094 -1.237755 -0.075345
N 0.958229 1.332692 0.182938
C -0.974455 -0.140468 -0.076532
C -2.400722 -0.284658 -0.221391
C -0.374456 1.180742 0.054458
C 1.169910 -1.082820 0.083453
C 1.757619 0.232099 0.221520
C -3.168803 0.865125 -0.184782
C -1.253861 2.352949 0.045241
C -3.003812 -1.639482 -0.421698
C -2.614129 2.174285 -0.070976
C 3.184150 0.375879 0.382551
C 2.067361 -2.235458 0.113733
C 3.981994 -0.750047 0.373672
C 3.433277 -2.047369 0.244544
C 3.773813 1.712492 0.564375
C -5.335523 0.262405 0.671181
C 0.520405 4.032610 0.270232
C -3.868017 -3.444102 0.937388
C 0.329772 -3.948542 -0.085977
H -3.910507 -1.593585 -1.055411
H -2.285603 -2.363433 -0.846488
H -3.292392 3.030121 -0.078589
H 5.070809 -0.650142 0.475090
H 4.094539 -2.915578 0.254806
H -4.876270 -0.658466 1.060389
H -6.282887 0.057219 0.162281
H -5.457149 1.007991 1.462675
H 1.059286 3.753194 -0.639611
H 0.989819 3.574146 1.151156
H 0.427465 5.119397 0.377527
H -3.075648 -4.131937 0.628930
H -4.757818 -3.561953 0.312322
H -4.114273 -3.593163 1.996349
H -0.248995 -3.582275 0.770057
H 0.429829 -5.040899 -0.074587
H -0.086023 -3.585628 -1.031172
H 5.557812 2.561505 0.328938


%chk=000291624-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291624

0 1
O -4.599474 0.816192 -0.312559
O -0.873177 3.716978 0.123444
O -3.296025 -2.268165 0.917130
O 1.636249 -3.546373 0.029603
O 5.267636 1.619365 0.511180
O 3.342050 2.828983 0.934554
N -0.175106 -1.206361 -0.071110
N 0.964577 1.382331 0.192723
C -0.986332 -0.102643 -0.071897
C -2.405263 -0.281048 -0.197454
C -0.379925 1.230180 0.048360
C 1.168213 -1.054030 0.096749
C 1.768669 0.278967 0.247938
C -3.198471 0.880286 -0.170470
C -1.256475 2.394829 0.017457
C -2.994476 -1.647893 -0.403019
C -2.638226 2.187237 -0.079605
C 3.200242 0.414156 0.417669
C 2.032827 -2.225813 0.120610
C 3.982820 -0.755199 0.394884
C 3.419066 -2.045141 0.252125
C 3.857330 1.722711 0.642831
C -5.338900 0.302625 0.868006
C 0.534093 4.179245 0.025685
C -3.808661 -3.628779 0.753738
C 0.230781 -4.000153 -0.030520
H -3.933640 -1.574895 -0.990187
H -2.268993 -2.292529 -0.936825
H -3.307516 3.051048 -0.091407
H 5.064859 -0.656072 0.509211
H 4.053782 -2.935363 0.260613
H -4.920424 -0.662693 1.207147
H -6.379982 0.185803 0.530567
H -5.290555 1.043359 1.689272
H 0.960062 3.901050 -0.953462
H 1.167862 3.745890 0.810506
H 0.447652 5.273146 0.116782
H -3.067683 -4.283997 0.245791
H -4.752522 -3.645685 0.166739
H -4.000960 -4.013123 1.767974
H -0.360725 -3.586209 0.800908
H 0.313842 -5.096391 0.038218
H -0.232305 -3.697758 -0.983209
H 5.651705 2.515429 0.707515


