%chk=000258039.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258039

0 1
O 2.162763 2.624269 -0.250746
O 3.772136 -2.771650 0.034851
O -5.434621 -1.631529 -0.519045
N -4.406992 0.087340 0.661079
C 0.809277 0.706298 -1.827275
C 1.965739 0.317941 -0.906878
C -0.568104 0.531002 -1.184856
C 2.640880 1.298650 -0.118173
C 2.389961 -1.019702 -0.810040
C -0.975209 1.348659 -0.097855
C -1.476101 -0.449845 -1.652339
C 3.457316 -1.399271 0.041513
C -3.140653 0.193372 0.013214
C 3.709848 0.930222 0.725875
C -2.240994 1.184436 0.492770
C -2.750723 -0.631087 -1.072427
C 4.123081 -0.421322 0.812609
C 2.889891 3.674284 0.460861
C -5.458187 -0.782993 0.390848
C 4.861201 -3.210332 0.906291
C -6.652138 -0.623938 1.332871
H 0.858696 0.087708 -2.742073
H 0.941453 1.760388 -2.130211
H 1.892504 -1.798517 -1.397828
H -0.290583 2.116829 0.278140
H -1.186612 -1.091339 -2.494031
H 4.234599 1.679208 1.326527
H -2.537102 1.829778 1.331391
H -3.441904 -1.389338 -1.444774
H 4.953067 -0.683774 1.475125
H -4.554181 0.741516 1.433864
H 3.950846 3.715593 0.144702
H 2.838316 3.530426 1.558343
H 2.385141 4.612958 0.187185
H 5.820881 -2.730628 0.628377
H 4.933862 -4.297304 0.753599
H 4.638077 -2.998318 1.970897
H -6.425204 -1.061617 2.323157
H -7.509083 -1.164154 0.905042
H -6.931745 0.435681 1.479321


%chk=000258039-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258039

0 1
O 2.171803 2.632045 -0.292387
O 3.772728 -2.761004 0.080156
O -5.456654 -1.637843 -0.536318
N -4.401195 0.067880 0.687560
C 0.804599 0.689044 -1.824746
C 1.966490 0.314920 -0.905519
C -0.569669 0.512461 -1.176230
C 2.649587 1.308467 -0.140155
C 2.388197 -1.021789 -0.786941
C -0.963510 1.314021 -0.072397
C -1.488181 -0.452195 -1.655763
C 3.461387 -1.387910 0.063120
C -3.137870 0.174914 0.031403
C 3.724781 0.953405 0.701775
C -2.227055 1.149766 0.523084
C -2.761170 -0.633286 -1.071668
C 4.135784 -0.397220 0.810167
C 2.903758 3.693423 0.397021
C -5.466159 -0.786958 0.402540
C 4.868792 -3.185653 0.949757
C -6.676577 -0.623829 1.322553
H 0.853615 0.063342 -2.734768
H 0.930111 1.741218 -2.137187
H 1.884025 -1.810221 -1.355885
H -0.271028 2.070667 0.312551
H -1.208357 -1.081142 -2.510111
H 4.256091 1.712280 1.283957
H -2.512794 1.782191 1.374912
H -3.460352 -1.379639 -1.452382
H 4.970805 -0.649235 1.470401
H -4.536028 0.708481 1.472668
H 3.961736 3.731552 0.070605
H 2.862447 3.565752 1.496940
H 2.395030 4.627183 0.114123
H 5.827002 -2.713982 0.653621
H 4.937300 -4.275567 0.817470
H 4.656223 -2.952510 2.012110
H -6.882436 -1.589263 1.816218
H -7.560340 -0.376373 0.709428
H -6.553517 0.152510 2.098217


