%chk=000277059.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277059

0 1
O 4.302820 1.311378 -0.271545
O -2.094181 3.368399 -0.134767
O 3.952443 -2.638063 -0.630346
O 5.020682 -1.361873 0.747504
O -5.716276 -1.775693 0.087018
O -5.724119 0.386457 0.001893
N -0.788505 2.934382 -0.125391
N 4.066626 -1.627237 0.038560
N -5.157222 -0.692252 0.040827
C 0.534120 -0.425332 0.004433
C -0.906267 -0.722196 0.021082
C 0.703658 1.003877 -0.057737
C -1.621135 0.522406 -0.024978
C -0.647643 1.643043 -0.075114
C 1.630895 -1.260382 0.028902
C 1.956371 1.571169 -0.094595
C -1.585912 -1.929476 0.070464
C -3.001695 0.552418 -0.019850
C 2.926924 -0.685110 0.013866
C 3.083089 0.709143 -0.062410
C -3.676853 -0.688788 0.032470
C -2.990894 -1.907897 0.075853
C 5.122572 1.533609 0.912037
H 1.523204 -2.349928 0.051205
H 2.108229 2.651528 -0.163999
H -1.053240 -2.879576 0.102458
H -3.564069 1.494629 -0.054989
H -3.557128 -2.847639 0.113959
H 5.346912 0.580993 1.410136
H 4.619636 2.241413 1.574654
H 6.028676 1.966806 0.467736
H -1.996618 4.386290 -0.181736


%chk=000277059-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277059

0 1
O 4.420955 1.162064 -0.279080
O -2.057192 3.358941 -0.054440
O 3.910727 -2.882120 -0.521302
O 5.134980 -1.361060 0.658951
O -5.807807 -1.778552 0.067660
O -5.780380 0.502550 0.033514
N -0.681717 2.921837 -0.061934
N 4.068732 -1.723907 0.030691
N -5.188267 -0.645041 0.043640
C 0.532496 -0.477533 -0.020830
C -0.916942 -0.740523 -0.001194
C 0.734211 0.941635 -0.043357
C -1.611182 0.519508 -0.013687
C -0.596143 1.600541 -0.041857
C 1.633939 -1.345031 -0.026512
C 2.021448 1.495047 -0.088644
C -1.633558 -1.952944 0.023840
C -3.015381 0.572325 0.000492
C 2.931426 -0.781203 -0.027321
C 3.146598 0.631706 -0.081137
C -3.704676 -0.663349 0.026906
C -3.044095 -1.914566 0.038180
C 5.102878 1.736936 0.904747
H 1.532322 -2.433736 -0.025045
H 2.176779 2.574846 -0.162466
H -1.114600 -2.916314 0.031779
H -3.565463 1.513209 -0.008458
H -3.644001 -2.828019 0.057819
H 5.355903 0.928321 1.611173
H 4.466771 2.502131 1.389472
H 6.018327 2.200356 0.510327
H -1.981991 4.348439 -0.074328


