%chk=000242939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242939

0 1
O -2.602603 -2.033096 0.272888
O 2.605129 2.037635 -0.249005
O -7.140515 -0.017400 0.268046
O 5.643591 -1.452461 -0.753794
O -5.640510 1.457032 0.778879
O 7.143255 0.022228 -0.242717
N -1.179849 -0.514498 -0.650122
N 1.182390 0.519044 0.674047
N -5.991110 0.364076 0.371354
N 5.993918 -0.359367 -0.346418
C -0.777000 0.903310 -0.834281
C -0.027081 -1.411794 -0.354905
C 0.029634 1.416331 0.378780
C 0.779593 -0.898787 0.858136
C -2.445001 -0.906810 -0.173608
C 2.447552 0.911389 0.197603
C -3.593823 0.070269 -0.339814
C 3.596421 -0.065571 0.364046
C -4.919106 -0.622064 -0.037080
C 4.921665 0.626819 0.061274
H -0.153469 0.962049 -1.759550
H -1.654905 1.555969 -1.016249
H -0.402633 -2.446477 -0.155594
H 0.608509 -1.466177 -1.265973
H 0.405195 2.451007 0.179472
H -0.605979 1.470714 1.289834
H 0.156132 -0.957599 1.783442
H 1.657551 -1.551420 1.039972
H -3.453034 0.941770 0.347198
H -3.607289 0.497930 -1.365277
H 3.609830 -0.493065 1.389593
H 3.455760 -0.937254 -0.322753
H -4.793740 -1.375972 0.787253
H -5.281341 -1.219019 -0.906734
H 5.283598 1.224270 0.930721
H 4.796363 1.380290 -0.763463


%chk=000242939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242939

0 1
O -2.794357 -2.137939 0.278076
O 2.796985 2.142569 -0.253920
O -7.377387 -0.024314 -0.112579
O 5.913463 -1.417003 -0.839059
O -5.910768 1.421591 0.863432
O 7.380012 0.029005 0.136903
N -1.286478 -0.487985 -0.362582
N 1.289086 0.492612 0.386690
N -6.194432 0.330099 0.240538
N 6.197076 -0.325468 -0.216215
C -0.901163 0.894092 -0.719424
C -0.148553 -1.426751 -0.255563
C 0.151163 1.431381 0.279666
C 0.903770 -0.889464 0.743531
C -2.572423 -0.939816 -0.091893
C 2.575036 0.944442 0.116026
C -3.721815 0.068644 -0.251123
C 3.724420 -0.064024 0.275283
C -5.062576 -0.650014 -0.069321
C 5.065189 0.654637 0.093556
H -0.470274 0.903961 -1.740695
H -1.779806 1.555802 -0.710732
H -0.546355 -2.398572 0.078956
H 0.317090 -1.549648 -1.253870
H 0.548968 2.403200 -0.054857
H -0.314480 1.554285 1.277971
H 0.472879 -0.899335 1.764802
H 1.782414 -1.551172 0.734838
H -3.644109 0.867961 0.510384
H -3.681552 0.561284 -1.239966
H 3.684114 -0.556686 1.264114
H 3.646742 -0.863326 -0.486240
H -5.013075 -1.354050 0.780149
H -5.386655 -1.214376 -0.955533
H 5.389207 1.219014 0.979781
H 5.015744 1.358667 -0.755922


