%chk=000233570.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233570

0 1
O -5.422551 0.057658 0.344169
O 5.422544 -0.057533 -0.344368
O -1.245058 -2.081393 -1.164679
O 1.244990 2.081224 1.165088
N -2.749697 0.301737 -0.625636
N 2.749755 -0.301709 0.625599
C -3.645317 -0.776775 -1.121242
C -3.532281 1.504613 -0.216935
C 3.645363 0.776840 1.121148
C 3.532364 -1.504557 0.216852
C -1.438479 0.148911 -0.279118
C 1.438492 -0.148949 0.279212
C -4.686997 -1.121239 -0.045917
C -4.574622 1.109445 0.843210
C 4.686972 1.121336 0.045763
C 4.574622 -1.109351 -0.843359
C -0.666363 -1.140734 -0.642887
C 0.666350 1.140656 0.643073
C -0.730250 1.157793 0.337729
C 0.730248 -1.157855 -0.337585
H -3.070948 -1.693660 -1.420070
H -4.148002 -0.408429 -2.045445
H -4.038059 1.910256 -1.124057
H -2.864442 2.311255 0.167441
H 4.148113 0.408525 2.045328
H 3.070979 1.693706 1.420008
H 2.864537 -2.311232 -0.167478
H 4.038219 -1.910176 1.123943
H -5.485474 -1.778138 -0.437217
H -4.227899 -1.576159 0.849096
H -4.103183 0.782211 1.786778
H -5.296304 1.923061 1.041024
H 4.227808 1.576244 -0.849223
H 5.485449 1.778261 0.437020
H 5.296322 -1.922939 -1.041219
H 4.103112 -0.782134 -1.786898
H -1.226088 2.087269 0.635060
H 1.226079 -2.087338 -0.634906


%chk=000233570-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233570

0 1
O -5.476141 0.085023 0.393509
O 5.476199 -0.083650 -0.392906
O -1.155585 -1.974291 -1.536185
O 1.155925 1.973141 1.535375
N -2.776853 0.286698 -0.650400
N 2.776792 -0.287202 0.650161
C -3.683694 -0.802277 -1.110941
C -3.568003 1.494566 -0.308906
C 3.682613 0.802538 1.110803
C 3.568944 -1.494571 0.309175
C -1.446348 0.147938 -0.303045
C 1.446317 -0.149033 0.302519
C -4.705240 -1.111738 0.005855
C -4.571744 1.162702 0.820108
C 4.704256 1.112596 -0.005740
C 4.572798 -1.162149 -0.819572
C -0.636546 -1.054909 -0.797457
C 0.636655 1.053922 0.796606
C -0.760043 1.111768 0.445080
C 0.760103 -1.112831 -0.445744
H -3.089423 -1.686503 -1.380798
H -4.221185 -0.441019 -2.008908
H -4.140407 1.781356 -1.212022
H -2.919349 2.338774 -0.035918
H 4.220076 0.441895 2.009032
H 3.087502 1.686335 1.380276
H 2.921083 -2.339372 0.036197
H 4.141300 -1.780694 1.212532
H -5.454704 -1.838552 -0.347002
H -4.177983 -1.523950 0.893067
H -4.024870 0.866909 1.741055
H -5.221031 2.026274 1.038887
H 4.176952 1.524221 -0.893197
H 5.453039 1.840066 0.347210
H 5.222845 -2.025251 -1.037946
H 4.025994 -0.866996 -1.740766
H -1.263145 1.986054 0.865149
H 1.263209 -1.987087 -0.865844


