%chk=000257892.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257892

0 1
O 5.642310 1.728809 -1.365953
O -5.613376 1.811516 1.341333
C 0.482359 -1.719176 0.567640
C -0.521436 -1.716566 -0.627557
C 0.908110 -3.192245 0.758039
C -0.989819 -3.180958 -0.814435
C -0.269080 -4.034539 0.243026
C 1.649414 -0.792958 0.328104
C -1.664414 -0.761800 -0.376297
C 1.835430 0.317561 1.167436
C -1.795407 0.389172 -1.169791
C 2.551803 -1.014274 -0.725150
C -2.596088 -0.998896 0.647809
C 2.906889 1.188800 0.962549
C -2.842840 1.285539 -0.948833
C 3.619623 -0.142353 -0.930259
C -3.639566 -0.102053 0.868836
C 3.808972 0.965773 -0.086211
C -3.774574 1.047148 0.070157
C 4.972869 1.861891 -0.361466
C -4.915100 1.968164 0.360094
C 5.296370 2.928369 0.646590
C -5.178623 3.090702 -0.603688
H -0.060427 -1.397369 1.491896
H 0.018965 -1.405752 -1.555371
H 1.138800 -3.407212 1.813858
H 1.827832 -3.422442 0.191117
H -0.740472 -3.526808 -1.832677
H -2.085226 -3.278217 -0.725430
H 0.074990 -4.993840 -0.177438
H -0.956065 -4.288678 1.069859
H 1.138767 0.506466 1.983283
H -1.074956 0.590185 -1.961632
H 2.418051 -1.870572 -1.385512
H -2.502126 -1.887277 1.271787
H 3.029810 2.045083 1.625830
H -2.923619 2.173265 -1.576251
H 4.322863 -0.308638 -1.753024
H -4.365795 -0.280131 1.668796
H 5.457570 2.512592 1.649021
H 4.498932 3.679054 0.716065
H 6.216806 3.463140 0.363302
H -5.330261 2.727409 -1.627760
H -4.354813 3.815467 -0.620474
H -6.086852 3.643550 -0.315818


%chk=000257892-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257892

0 1
O 5.336989 2.128759 -1.303302
O -5.270344 2.218378 1.321966
C 0.545431 -2.032706 0.499945
C -0.593181 -2.020931 -0.595504
C 1.065225 -3.495088 0.440082
C -1.178773 -3.481344 -0.575309
C -0.232442 -4.330311 0.330479
C 1.594318 -0.949756 0.310105
C -1.613769 -0.913493 -0.382465
C 1.729918 0.099197 1.254772
C -1.709600 0.172642 -1.288487
C 2.457877 -0.946297 -0.821630
C -2.486769 -0.925851 0.742214
C 2.693057 1.115449 1.085913
C -2.642326 1.211580 -1.087507
C 3.419355 0.062926 -0.995518
C -3.416800 0.105811 0.948817
C 3.553425 1.111369 -0.043160
C -3.510662 1.192865 0.035232
C 4.596923 2.166811 -0.275163
C -4.522198 2.271154 0.300259
C 4.752964 3.287574 0.748583
C -4.636168 3.433747 -0.681534
H 0.062050 -1.883411 1.486840
H -0.101882 -1.849001 -1.572839
H 1.682569 -3.754719 1.318259
H 1.693056 -3.638002 -0.460498
H -1.210134 -3.881182 -1.604622
H -2.216360 -3.492279 -0.199476
H -0.053123 -5.341743 -0.074668
H -0.678549 -4.455165 1.335613
H 1.068084 0.118186 2.128955
H -1.041762 0.203046 -2.157795
H 2.378634 -1.743513 -1.570766
H -2.437713 -1.756062 1.458060
H 2.767814 1.909813 1.836393
H -2.687762 2.034471 -1.809040
H 4.089062 0.070921 -1.862279
H -4.092144 0.102869 1.811234
H 5.008958 2.882088 1.745212
H 3.814302 3.862525 0.856316
H 5.554691 3.965251 0.418678
H -4.894605 3.074070 -1.694938
H -3.680213 3.984511 -0.759554
H -5.420823 4.121744 -0.332473


