%chk=000273520.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273520

0 1
O 4.472004 1.409368 -0.620975
O 3.500624 -0.073238 -2.020672
O -6.022131 -0.288033 -1.018753
O -5.412904 0.840857 0.844763
N -0.175951 0.480257 0.109165
N 2.030090 -3.577329 -0.176358
C 1.125393 -0.102844 -0.369301
C 1.426438 0.756689 2.040415
C 2.136134 1.092284 -0.352121
C 2.382702 1.541504 1.105992
C -0.028658 0.969533 1.526112
C 1.616494 -1.160188 0.620928
C 1.755923 -0.711163 1.884218
C -1.307768 -0.487709 -0.055678
C 3.391049 0.701486 -1.100260
C -2.630952 0.292672 0.002967
C 1.849358 -2.492334 0.181762
C -3.816401 -0.620357 -0.322489
C -5.115963 0.083556 -0.047463
C 5.747925 1.162679 -1.272883
C -7.360388 0.266314 -0.915431
H 1.010173 -0.502253 -1.404555
H 1.523668 1.104493 3.088183
H 1.668767 1.941630 -0.922765
H 3.435847 1.371830 1.404893
H 2.211236 2.628059 1.205295
H -0.268410 2.054984 1.504580
H -0.747972 0.490097 2.219066
H 2.072400 -1.292127 2.738477
H -1.208961 -0.978410 -1.050496
H -1.299016 -1.301979 0.700516
H -2.772433 0.752545 1.003438
H -2.594154 1.144503 -0.708534
H -3.776853 -0.963236 -1.380267
H -3.785690 -1.548631 0.289949
H 5.674406 1.422248 -2.333762
H 6.424813 1.831092 -0.731373
H 6.023282 0.110017 -1.151844
H -7.864622 -0.160927 -1.788486
H -7.820009 -0.057844 0.023246
H -7.310191 1.358603 -0.964797


%chk=000273520-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273520

0 1
O 4.531675 1.515647 -0.667854
O 3.597351 -0.237260 -1.876829
O -6.156384 -0.353997 -1.010718
O -5.362638 1.113987 0.613471
N -0.124994 0.406741 0.158867
N 2.093115 -3.700950 -0.095079
C 1.183892 -0.149391 -0.308530
C 1.426501 0.711041 2.097210
C 2.188961 1.043375 -0.298219
C 2.362770 1.552824 1.169875
C -0.042170 0.875704 1.577391
C 1.681668 -1.225018 0.677453
C 1.794372 -0.750167 1.960425
C -1.301406 -0.450811 -0.123558
C 3.478180 0.670981 -1.022631
C -2.612131 0.362393 -0.102148
C 1.915845 -2.575738 0.276735
C -3.828910 -0.521141 -0.446544
C -5.151164 0.187410 -0.202101
C 5.812686 1.274629 -1.379374
C -7.512070 0.219046 -0.821614
H 1.076581 -0.544780 -1.329443
H 1.497489 1.064692 3.139398
H 1.713706 1.841093 -0.903890
H 3.409527 1.455162 1.497840
H 2.090263 2.620427 1.245480
H -0.340621 1.939441 1.656208
H -0.726404 0.282509 2.222327
H 2.089369 -1.370638 2.812151
H -1.161714 -0.897663 -1.126705
H -1.384868 -1.297014 0.604499
H -2.770897 0.816787 0.893124
H -2.526992 1.197170 -0.822098
H -3.800994 -0.875192 -1.492188
H -3.825462 -1.431886 0.188895
H 5.674284 1.405243 -2.465639
H 6.504310 2.025241 -0.972432
H 6.170324 0.250555 -1.181580
H -8.149486 -0.330540 -1.528085
H -7.849106 0.070225 0.218088
H -7.505159 1.298563 -1.047476


