%chk=000251684.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251684

0 1
O -2.437572 -0.849810 -1.221826
O -2.785900 3.568691 0.366202
O 0.701620 1.487533 1.622980
O -3.576980 3.208372 -1.693702
O 3.868651 -1.359942 -0.810681
N -2.009260 0.850606 0.229937
C -2.361625 -1.407835 1.166115
C -3.005885 -2.758558 0.798720
C -0.968283 -1.614271 1.792092
C -2.085119 -3.624217 -0.071632
C -0.059702 -2.470627 0.900037
C -0.711520 -3.822701 0.580844
C -2.259450 -0.509085 -0.067481
C -1.720525 1.797227 -0.860993
C -0.331008 2.453679 -0.722219
C 0.763652 1.431624 -0.716700
C -2.797007 2.889091 -0.832179
C 1.315140 0.968995 0.495745
C 1.272459 0.906485 -1.914386
C 2.309421 -0.026932 -1.930122
C 2.365214 0.041950 0.533862
C 2.848387 -0.445031 -0.685063
C 2.828418 -0.579421 -3.214735
C 1.383368 1.341587 2.892022
C 4.499217 -1.851023 0.396531
H -3.022887 -0.901690 1.914809
H -3.263151 -3.297777 1.729738
H -3.958597 -2.581247 0.260918
H -0.484443 -0.637931 1.991875
H -1.093543 -2.106606 2.776143
H -2.561504 -4.601205 -0.268029
H -1.963093 -3.133511 -1.063096
H 0.157092 -1.928452 -0.043959
H 0.917254 -2.623204 1.392545
H -0.056942 -4.405505 -0.093905
H -0.814401 -4.421566 1.504928
H -1.659407 1.135299 1.147258
H -1.807787 1.258726 -1.855165
H -0.291936 3.058193 0.215306
H -0.178689 3.179399 -1.547967
H 0.843084 1.239008 -2.862340
H 2.778860 -0.292383 1.475220
H 3.770377 -1.132125 -3.073540
H 2.107903 -1.281095 -3.660452
H 3.022946 0.211359 -3.950825
H -3.492336 4.266132 0.414535
H 0.737493 1.923100 3.562937
H 1.414750 0.289148 3.187298
H 2.384827 1.778926 2.839264
H 5.252347 -2.538715 -0.011106
H 4.973375 -1.029292 0.940216
H 3.772996 -2.387974 1.013123


%chk=000251684-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251684

0 1
O -3.399062 -0.599543 -0.743666
O -3.374602 2.539870 0.020649
O 0.928463 1.194067 1.547815
O -3.027837 2.749719 -2.266227
O 4.822231 -0.542242 -1.004508
N -1.577776 0.462618 0.185042
C -2.638255 -1.354157 1.501860
C -3.757991 -2.421957 1.402838
C -1.277606 -2.030248 1.852980
C -3.396386 -3.574873 0.434871
C -0.914150 -3.151272 0.850718
C -2.033444 -4.218067 0.786061
C -2.573793 -0.493308 0.220392
C -1.462239 1.364738 -0.959295
C -0.204557 2.280096 -0.815320
C 1.107466 1.513555 -0.827393
C -2.696976 2.252900 -1.168121
C 1.682158 0.994513 0.360503
C 1.817813 1.302408 -2.034233
C 3.049243 0.617159 -2.104464
C 2.918446 0.308601 0.349016
C 3.590426 0.125129 -0.883322
C 3.787273 0.410213 -3.410051
C 1.572753 0.904298 2.831853
C 5.433089 -1.082201 0.210212
H -2.894566 -0.650458 2.323179
H -3.933186 -2.832647 2.418763
H -4.694237 -1.940432 1.068507
H -0.461449 -1.283067 1.902730
H -1.369311 -2.471127 2.867259
H -4.194967 -4.341768 0.460253
H -3.366534 -3.172175 -0.594505
H -0.764404 -2.710709 -0.155731
H 0.047266 -3.617991 1.142625
H -1.776131 -4.996362 0.041534
H -2.106153 -4.726550 1.771081
H -0.920968 0.596184 0.962208
H -1.379609 0.777810 -1.893393
H -0.299848 2.861879 0.119703
H -0.220648 2.990805 -1.660290
H 1.391140 1.701796 -2.962902
H 3.344054 -0.083395 1.275521
H 4.795712 0.862110 -3.376790
H 3.936222 -0.665128 -3.618918
H 3.231085 0.855691 -4.252226
H -4.162552 3.109426 -0.192718
H 0.857374 1.240021 3.597349
H 1.763105 -0.179798 2.954143
H 2.520626 1.465697 2.932977
H 6.369911 -1.552126 -0.123272
H 5.659873 -0.279800 0.939712
H 4.783806 -1.844502 0.684089


