%chk=000246949.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246949

0 1
O 3.825206 -2.633317 0.849913
O 2.170101 1.766178 1.719731
N -0.955972 -0.313200 -0.566497
N 2.007929 -0.648261 -0.103210
C -0.107990 0.750336 0.036902
C 1.418138 0.704387 -0.313472
C -0.539569 -0.780901 -1.924311
C -1.528407 -1.293264 0.295910
C -1.655394 -1.634435 -2.536937
C -0.652750 2.115068 -0.376548
C 3.434892 -0.684245 -0.574646
C 1.932563 -1.137056 1.312189
C -1.867966 -2.883257 -1.677302
C -2.024779 -2.523489 -0.225642
C 2.109742 1.816769 0.513144
C 3.921555 -2.141863 -0.499461
C 2.475485 -2.572867 1.359726
C -1.729195 -1.012580 1.665428
C -0.989971 3.035267 0.628346
C -0.806373 2.479196 -1.720682
C -2.673823 -3.419686 0.625586
C 2.686707 2.949279 -0.279055
C -2.382117 -1.924591 2.494542
C -2.851535 -3.134405 1.983997
C -1.468773 4.303216 0.288631
C -1.287087 3.747070 -2.058403
C -1.616274 4.663082 -1.054817
H -0.180069 0.670933 1.166723
H 1.534609 0.928488 -1.407412
H 0.408907 -1.365416 -1.877652
H -0.355062 0.119563 -2.556617
H -1.397556 -1.910630 -3.574702
H -2.596173 -1.049124 -2.591395
H 4.106733 -0.038945 0.032536
H 3.480490 -0.325937 -1.623168
H 0.869925 -1.135108 1.640068
H 2.491385 -0.486102 2.023937
H -1.008694 -3.577696 -1.788858
H -2.756924 -3.439235 -2.037214
H 3.340674 -2.801897 -1.167672
H 5.001283 -2.231104 -0.711604
H 2.598874 -2.934555 2.395857
H 1.843517 -3.269880 0.781348
H -1.387819 -0.065450 2.085177
H -0.881670 2.765740 1.679170
H -0.572131 1.757295 -2.508255
H -3.051293 -4.361282 0.227192
H 1.894869 3.502537 -0.809600
H 3.198654 3.673160 0.374142
H 3.412825 2.613071 -1.028064
H -2.525392 -1.684045 3.547168
H -3.356157 -3.846919 2.629202
H -1.730739 5.010998 1.074063
H -1.411146 4.018951 -3.105233
H -1.991962 5.650054 -1.317400


%chk=000246949-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246949

0 1
O 3.597822 -2.872560 0.667704
O 1.977706 1.979907 1.808478
N -0.795549 -0.305764 -0.475975
N 2.057403 -0.532846 -0.023054
C -0.059888 0.865751 0.044596
C 1.472344 0.808560 -0.276332
C -0.645750 -0.563397 -1.923890
C -1.436198 -1.233435 0.374391
C -1.666969 -1.586313 -2.445629
C -0.694826 2.192701 -0.415288
C 3.354388 -0.810626 -0.685762
C 2.033961 -1.061592 1.365161
C -1.585724 -2.866025 -1.589418
C -1.835633 -2.520570 -0.129327
C 2.209083 1.883286 0.569519
C 3.595674 -2.332713 -0.698022
C 2.310001 -2.574788 1.323977
C -1.724993 -0.937577 1.743443
C -1.749354 2.744469 0.358217
C -0.311173 2.871948 -1.601277
C -2.476066 -3.439153 0.728170
C 3.274862 2.719701 -0.118066
C -2.347546 -1.882970 2.583403
C -2.728379 -3.149291 2.088405
C -2.402510 3.930791 -0.036617
C -0.964026 4.059933 -2.003932
C -2.012533 4.594845 -1.223731
H -0.121614 0.851441 1.143928
H 1.651664 1.014498 -1.347495
H 0.380946 -0.936358 -2.132536
H -0.775675 0.395899 -2.461154
H -1.445314 -1.800690 -3.507673
H -2.687839 -1.163800 -2.391485
H 4.215166 -0.325175 -0.164658
H 3.320320 -0.431818 -1.725895
H 1.041082 -0.896204 1.813670
H 2.787591 -0.558212 2.012601
H -0.579796 -3.319636 -1.715927
H -2.319685 -3.618539 -1.931294
H 2.800401 -2.826180 -1.299376
H 4.586713 -2.575894 -1.116805
H 2.399123 -2.986542 2.342307
H 1.485762 -3.086725 0.783095
H -1.489122 0.043010 2.167141
H -2.061858 2.237547 1.278636
H 0.500514 2.482657 -2.227232
H -2.778042 -4.410089 0.314080
H 2.813327 3.328884 -0.918957
H 3.770607 3.384085 0.606894
H 4.030892 2.071106 -0.601588
H -2.546757 -1.615053 3.627640
H -3.219066 -3.882710 2.736130
H -3.210923 4.339398 0.579859
H -0.652972 4.565962 -2.925060
H -2.517271 5.516760 -1.533191


