%chk=000241277.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241277

0 1
O 1.129009 -0.501255 -0.218451
O 0.734341 1.207552 -1.786585
O -4.593162 -2.099037 1.378733
O -2.605418 -2.919575 1.601112
N -3.400162 -2.129023 1.118838
C 2.909227 1.119607 -0.639881
C 2.578307 -0.355942 -0.311706
C 2.147079 1.474955 -1.930643
C 3.075214 -0.854397 1.045584
C 2.515513 2.081241 0.495756
C 0.427486 -0.145656 -1.412701
C 3.226435 -2.381402 1.075184
C 3.071547 3.487488 0.292100
C -1.043230 -0.174574 -1.069339
C 3.689279 -2.872172 2.444095
C -1.514527 -1.109277 -0.140659
C -1.927000 0.727689 -1.678828
C -2.886208 -1.140284 0.147397
C -3.293014 0.685686 -1.376977
C -3.782929 -0.248625 -0.464527
H 4.005836 1.206781 -0.827615
H 2.926265 -1.013657 -1.140955
H 2.148631 2.561738 -2.137960
H 2.524755 0.924177 -2.808111
H 2.350751 -0.540753 1.829669
H 4.035857 -0.369535 1.302939
H 2.864675 1.687404 1.469261
H 1.405628 2.109716 0.564359
H 0.713655 -0.829691 -2.239029
H 3.942981 -2.710427 0.298025
H 2.254557 -2.851363 0.817691
H 2.687681 3.949432 -0.625013
H 2.785853 4.142984 1.124016
H 4.165316 3.491567 0.234649
H 4.659261 -2.446841 2.724018
H 2.973636 -2.605365 3.231391
H 3.792523 -3.963560 2.457952
H -0.820505 -1.796454 0.363132
H -1.535612 1.471074 -2.381154
H -3.976357 1.389349 -1.853364
H -4.848976 -0.294575 -0.217702


%chk=000241277-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241277

0 1
O 1.097091 -0.383385 -0.034647
O 0.683595 1.389795 -1.631402
O -4.761866 -2.415215 1.110741
O -2.624688 -3.097161 1.514259
N -3.484115 -2.319837 0.944736
C 2.954965 1.159653 -0.623904
C 2.575206 -0.301568 -0.242304
C 2.137087 1.528818 -1.885846
C 3.229147 -0.859050 1.026610
C 2.755302 2.163890 0.540454
C 0.386713 0.012664 -1.243710
C 3.049035 -2.385963 1.183497
C 3.178596 3.609740 0.200972
C -1.103653 -0.116319 -0.996962
C 3.670445 -2.922294 2.490127
C -1.584009 -1.127872 -0.138913
C -2.016197 0.748703 -1.648627
C -2.976242 -1.254440 0.042918
C -3.408070 0.602435 -1.446849
C -3.905750 -0.406141 -0.597697
H 4.028485 1.161298 -0.914424
H 2.825984 -0.960236 -1.109882
H 2.277466 2.576349 -2.190900
H 2.419682 0.864308 -2.733478
H 2.795858 -0.347772 1.906978
H 4.309958 -0.608777 1.005516
H 3.349186 1.818922 1.408116
H 1.694936 2.145045 0.852716
H 0.726228 -0.655427 -2.077539
H 3.507360 -2.901284 0.314090
H 1.968326 -2.622265 1.158214
H 2.520549 4.067886 -0.559239
H 3.129370 4.249866 1.100514
H 4.217717 3.647435 -0.179847
H 4.756955 -2.715809 2.532200
H 3.203480 -2.447731 3.373508
H 3.530170 -4.014512 2.582641
H -0.896085 -1.790808 0.390115
H -1.623320 1.539015 -2.294297
H -4.105257 1.278710 -1.951705
H -4.975443 -0.545666 -0.422051


