%chk=000254467.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254467

0 1
O -2.074285 -1.141275 1.370834
O 2.004860 0.489695 -1.694506
O 1.021224 0.526124 0.376157
O -5.405949 1.693143 0.809480
O -4.489099 2.090540 -1.221720
N 0.034701 -0.571936 -1.460438
N -2.295870 0.501867 -0.198921
C -0.869087 -1.495201 -0.708343
C -0.088737 -2.603907 0.035774
C -1.765614 -2.245586 -1.726229
C 0.020712 -3.780432 -0.944858
C -1.043561 -3.566319 -2.040724
C -1.762288 -0.693202 0.281117
C -3.080987 1.372946 0.694858
C -2.328808 2.662394 1.143506
C 1.025622 0.149973 -0.777022
C -4.351142 1.760697 -0.068741
C -1.825476 3.484854 -0.044018
C -1.181999 2.285391 2.080072
C 3.102830 1.328275 -1.207168
C 4.166144 0.457446 -0.601767
C -6.717386 2.056633 0.301011
C 4.037039 0.018320 0.724551
C 5.287325 0.083754 -1.355750
C 5.029680 -0.782279 1.293982
C 6.279355 -0.715941 -0.780370
C 6.152544 -1.148020 0.543589
H 0.893794 -2.259979 0.397881
H -0.647599 -2.900192 0.951407
H -2.757032 -2.447233 -1.273135
H -1.970965 -1.650385 -2.631767
H 1.031221 -3.831506 -1.386411
H -0.134106 -4.740164 -0.422150
H -1.760163 -4.405663 -2.065965
H -0.575844 -3.533970 -3.039472
H 0.292109 -0.905792 -2.398905
H -1.946941 0.935790 -1.054500
H -3.369457 0.782611 1.619673
H -3.069950 3.279457 1.716203
H -1.499934 4.479803 0.281144
H -2.601369 3.627744 -0.808048
H -0.963530 3.015155 -0.531984
H -0.422968 1.664013 1.574203
H -1.528884 1.710105 2.946228
H -0.665820 3.174391 2.456358
H 3.414839 1.826811 -2.144501
H 2.702008 2.072324 -0.492217
H -6.766423 3.144822 0.202842
H -6.899037 1.569545 -0.662889
H -7.389710 1.684102 1.081163
H 3.151550 0.297532 1.304650
H 5.387347 0.410937 -2.389295
H 4.927884 -1.121552 2.323899
H 7.151080 -1.003471 -1.365644
H 6.926652 -1.769888 0.990075


%chk=000254467-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254467

0 1
O -2.846716 -1.452543 1.299511
O 1.626625 0.479564 -1.656081
O 0.984020 0.275017 0.610289
O -5.189275 2.610178 -0.119459
O -3.621052 2.092782 -1.761943
N -0.115702 -0.876651 -1.131867
N -2.300526 0.386022 -0.020330
C -1.019973 -1.728630 -0.318473
C -0.238146 -2.630940 0.678691
C -1.661100 -2.789965 -1.265686
C 0.379302 -3.748444 -0.203015
C -0.580948 -3.902307 -1.432117
C -2.127665 -0.911441 0.402223
C -3.316535 1.266184 0.557158
C -2.734338 2.291837 1.600884
C 0.839395 -0.032751 -0.602903
C -4.026529 2.001483 -0.579035
C -1.721667 3.269567 0.960251
C -2.094093 1.537099 2.787745
C 2.752826 1.383723 -1.238896
C 4.032229 0.607476 -1.012017
C -5.945516 3.401821 -1.122227
C 4.294780 0.009403 0.248452
C 4.983011 0.467745 -2.054629
C 5.485786 -0.720353 0.456560
C 6.175877 -0.260551 -1.846781
C 6.429109 -0.856830 -0.589505
H 0.506020 -2.057826 1.254356
H -0.979826 -3.036662 1.388260
H -2.551594 -3.188959 -0.750452
H -1.998730 -2.353303 -2.224565
H 1.391146 -3.460360 -0.541197
H 0.483251 -4.691282 0.362165
H -1.055002 -4.899090 -1.463062
H -0.024641 -3.784521 -2.380250
H -0.049424 -1.057406 -2.136003
H -1.747790 0.733279 -0.807705
H -4.043031 0.623508 1.088786
H -3.608669 2.867479 1.965437
H -1.378933 4.002422 1.712951
H -2.154827 3.833026 0.112819
H -0.828690 2.725047 0.600069
H -1.193031 0.988374 2.459524
H -2.793995 0.807423 3.232010
H -1.789339 2.254758 3.571831
H 2.838680 2.080864 -2.087140
H 2.433152 1.918845 -0.327855
H -5.303730 4.190121 -1.549900
H -6.301558 2.743929 -1.932447
H -6.786700 3.831691 -0.561399
H 3.557065 0.113906 1.052100
H 4.786758 0.928709 -3.030757
H 5.681105 -1.178101 1.432776
H 6.905142 -0.360537 -2.658482
H 7.354510 -1.420526 -0.425471


