%chk=000231689.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231689

0 1
O 2.142791 -1.010243 -0.401133
O -2.127648 1.044722 -0.404608
O 1.464231 0.499456 -1.939951
O -1.439842 -0.450439 -1.953475
C 0.006268 0.015133 -0.019348
C 0.363986 1.224671 0.839263
C -0.356801 -1.202851 0.824960
C 1.242901 -0.126373 -0.933202
C -1.224665 0.165716 -0.939445
C -0.038519 2.521143 0.495884
C 0.048296 -2.495833 0.471580
C 1.180474 1.028081 1.966917
C -1.180775 -1.017445 1.949036
C 0.348146 3.607317 1.288341
C -0.343386 -3.589768 1.250759
C 1.563340 2.114916 2.753688
C -1.568639 -2.112012 2.722556
C 1.145422 3.407766 2.417751
C -1.148220 -3.401425 2.376748
C 3.406918 -1.207788 -1.120970
C -3.387177 1.249529 -1.130471
C 3.178672 -2.086769 -2.331048
C -3.151060 2.139868 -2.330686
H -0.661166 2.693396 -0.384916
H 0.676832 -2.659326 -0.406701
H 1.518644 0.022185 2.224549
H -1.520829 -0.014174 2.214312
H 0.026418 4.611940 1.018080
H -0.019650 -4.591655 0.972841
H 2.191060 1.955650 3.628983
H -2.202203 -1.961402 3.595168
H 1.444492 4.254543 3.032822
H -1.451192 -4.254262 2.981449
H 3.817538 -0.216629 -1.383933
H 4.011608 -1.691322 -0.332011
H -3.796404 0.261047 -1.405399
H -3.996660 1.725770 -0.340767
H 2.681620 -3.028116 -2.065800
H 2.539741 -1.582067 -3.073956
H 4.122894 -2.335971 -2.829890
H -2.507728 1.641959 -3.074382
H -2.655269 3.078411 -2.053412
H -4.092063 2.394250 -2.832982


%chk=000231689-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231689

0 1
O 2.213562 -0.966726 -0.344733
O -2.197585 1.000356 -0.350153
O 1.430227 0.461696 -2.007461
O -1.401546 -0.410161 -2.022071
C 0.007151 0.015881 -0.023955
C 0.401351 1.252928 0.824049
C -0.393205 -1.229587 0.808785
C 1.252602 -0.157574 -0.937743
C -1.231824 0.198216 -0.944836
C 0.175335 2.569911 0.352434
C -0.165715 -2.541680 0.324426
C 1.144713 1.073432 2.018191
C -1.143408 -1.062091 2.000363
C 0.646829 3.683283 1.080781
C -0.642848 -3.662272 1.037852
C 1.616373 2.186306 2.747011
C -1.620656 -2.182195 2.714322
C 1.364123 3.498295 2.284849
C -1.367172 -3.489426 2.239521
C 3.528461 -1.062206 -1.057525
C -3.508285 1.100697 -1.069985
C 3.487243 -2.156336 -2.127294
C -3.462823 2.205371 -2.128681
H -0.367846 2.729389 -0.583091
H 0.382974 -2.691670 -0.609469
H 1.364127 0.060292 2.370133
H -1.363699 -0.052529 2.361879
H 0.458214 4.695115 0.704933
H -0.453082 -4.670222 0.652272
H 2.185762 2.028063 3.669762
H -2.195317 -2.033225 3.635348
H 1.729823 4.363595 2.849132
H -1.737240 -4.360319 2.792227
H 3.756485 -0.075873 -1.498379
H 4.238573 -1.295005 -0.248290
H -3.731957 0.118360 -1.521855
H -4.223633 1.324297 -0.262756
H 3.209829 -3.129836 -1.686963
H 2.765475 -1.900187 -2.920705
H 4.486024 -2.260508 -2.590697
H -2.736637 1.958096 -2.920892
H -3.189053 3.174834 -1.677308
H -4.459330 2.312811 -2.596228


