%chk=000240642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240642

0 1
O 0.718312 -0.594427 -1.744571
O -0.717217 -0.595581 1.745904
O 1.460138 2.879859 2.411861
O -1.466274 2.874684 -2.417027
O 3.286970 2.973074 1.120493
O -3.282900 2.976987 -1.112058
N 2.164342 -1.806164 -0.436577
N -2.162162 -1.806802 0.436265
C 0.208434 -3.374644 -0.736483
C -0.205953 -3.374971 0.735440
C 1.713202 -3.131678 -0.936023
C -1.710784 -3.132483 0.935042
C 1.580065 -0.624982 -0.877189
C -1.578567 -0.625756 0.878087
C 2.149072 0.618381 -0.261454
C -2.147690 0.617966 0.263204
C 1.702731 1.128253 0.885050
C -1.702679 1.127785 -0.883849
C 2.272932 2.384895 1.420656
C -2.273030 2.384806 -1.418367
H -0.070190 -4.332375 -1.215657
H -0.347524 -2.587425 -1.295562
H 0.072926 -4.332802 1.214267
H 0.349774 -2.587812 1.294821
H 2.312114 -3.916093 -0.425406
H 1.947356 -3.190432 -2.026542
H -1.944970 -3.191862 2.025522
H -2.309499 -3.916756 0.423977
H 2.760505 -1.809732 0.386222
H -2.757879 -1.809992 -0.386850
H 2.936534 1.094465 -0.861280
H -2.933959 1.094535 0.864257
H 0.893524 0.676882 1.492358
H -0.894448 0.676174 -1.492266
H 1.805347 3.730695 2.798799
H -1.811754 3.725629 -2.803466


%chk=000240642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240642

0 1
O 1.053503 -0.656956 -2.120609
O -1.050502 -0.658461 2.120172
O 1.915389 2.522136 2.774787
O -1.917567 2.520768 -2.774358
O 2.585284 3.367564 0.711151
O -2.584283 3.366688 -0.709875
N 2.069419 -1.732810 -0.318153
N -2.068375 -1.733840 0.318521
C 0.270212 -3.445464 -0.724658
C -0.268413 -3.446114 0.723625
C 1.774213 -3.090762 -0.821089
C -1.772514 -3.091981 0.820583
C 1.673822 -0.603047 -1.006448
C -1.671993 -0.604270 1.006672
C 2.020184 0.717206 -0.389442
C -2.018635 0.716139 0.390158
C 1.833002 1.041029 0.921336
C -1.832859 1.039966 -0.920814
C 2.151318 2.410521 1.397299
C -2.151155 2.409569 -1.396438
H 0.113883 -4.432298 -1.203136
H -0.274599 -2.702283 -1.334867
H -0.111781 -4.433305 1.201267
H 0.276227 -2.703271 1.334399
H 2.386693 -3.803596 -0.239617
H 2.089482 -3.145131 -1.879958
H -2.087485 -3.147122 1.879510
H -2.384902 -3.804678 0.238849
H 2.595797 -1.617262 0.549027
H -2.595793 -1.618033 -0.547993
H 2.362915 1.489440 -1.090319
H -2.360174 1.488485 1.091490
H 1.401713 0.352890 1.657497
H -1.402729 0.351674 -1.657487
H 2.124277 3.450161 3.068328
H -2.126778 3.448749 -3.067812


