%chk=000272606.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272606

0 1
O 2.035399 2.224363 1.891314
O 1.934115 3.005597 -0.226362
N 3.204151 2.994595 2.087136
C 0.334014 -0.021839 0.088621
C -0.379583 1.056375 -0.737962
C 0.245811 1.425848 0.604466
C 1.642028 -0.557473 -0.409317
C -0.440575 -1.066642 0.832402
C -1.851217 1.044128 -0.949664
C 1.444162 2.296059 0.619336
C 1.726356 -1.102048 -1.698467
C -1.315956 -1.919365 0.145977
C 2.770549 -0.545385 0.423280
C -0.260469 -1.211687 2.216204
C -2.343489 0.547937 -2.169918
C -2.749194 1.519784 0.015894
C 2.939436 -1.626805 -2.153146
C -2.013607 -2.908605 0.844873
C 3.979522 -1.072295 -0.037370
C -0.960605 -2.202988 2.908215
C -3.718005 0.525810 -2.413130
C -4.124701 1.497100 -0.234853
C 4.066280 -1.612345 -1.324956
C -1.837983 -3.051602 2.224776
C -4.611953 1.000141 -1.446669
H 0.162532 1.425425 -1.631613
H -0.412502 1.609722 1.472070
H 0.848598 -1.119481 -2.341742
H -1.456901 -1.806348 -0.928107
H 2.703085 -0.125165 1.429159
H 0.428291 -0.556578 2.749063
H -1.653631 0.182403 -2.928194
H -2.380728 1.908396 0.963927
H 3.005861 -2.048554 -3.154829
H -2.695979 -3.568473 0.311566
H 4.855345 -1.064136 0.610061
H -0.820395 -2.315511 3.982176
H -4.095208 0.140087 -3.359108
H -4.817360 1.868011 0.519461
H 5.009600 -2.022065 -1.681349
H -2.382157 -3.822850 2.766407
H -5.682751 0.982916 -1.639141
H 2.955909 3.971863 1.927444
H 3.872107 2.731986 1.360270


%chk=000272606-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000272606

0 1
O 1.745401 2.819427 1.780944
O 2.266862 2.452035 -0.466927
N 3.008740 3.622151 1.842172
C 0.375198 -0.124688 0.113830
C -0.351233 0.936190 -0.746406
C 0.319288 1.360236 0.580055
C 1.676023 -0.698052 -0.420093
C -0.415760 -1.121676 0.940622
C -1.829411 1.027035 -0.968020
C 1.513229 2.234328 0.512775
C 1.766646 -1.165064 -1.753497
C -1.166165 -2.134104 0.291084
C 2.794964 -0.844293 0.437604
C -0.362144 -1.108273 2.356458
C -2.293928 1.239754 -2.294224
C -2.790645 0.922893 0.072695
C 2.955063 -1.765983 -2.224715
C -1.854214 -3.110404 1.042565
C 3.984511 -1.440399 -0.031532
C -1.049992 -2.085373 3.111048
C -3.673347 1.341489 -2.576842
C -4.170060 1.026523 -0.207722
C 4.068055 -1.906299 -1.364637
C -1.798511 -3.090227 2.456279
C -4.619808 1.234835 -1.532160
H 0.243447 1.239711 -1.617966
H -0.334111 1.559322 1.434128
H 0.907079 -1.053461 -2.425241
H -1.213773 -2.151184 -0.803671
H 2.735771 -0.485768 1.472594
H 0.222067 -0.335231 2.869947
H -1.565195 1.333712 -3.109159
H -2.469473 0.753995 1.106075
H 3.013838 -2.121119 -3.259792
H -2.435173 -3.883884 0.527899
H 4.845337 -1.539432 0.639102
H -0.998359 -2.064554 4.205485
H -4.007776 1.508743 -3.606941
H -4.895444 0.942487 0.609329
H 4.991583 -2.369534 -1.729669
H -2.332137 -3.848677 3.039960
H -5.691311 1.315924 -1.746055
H 2.667664 4.563586 2.106598
H 3.375406 3.623614 0.864224


