%chk=000259810.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259810

0 1
O -1.961081 -1.151761 -0.938820
O -2.445187 -2.226391 2.137489
O -2.628626 1.196347 1.425295
O -3.383137 1.356218 -2.394310
O 1.070559 -3.118188 -0.749374
O 4.138377 1.476161 -0.410554
N 0.209679 -1.050878 0.024343
N 0.127047 1.423330 0.619283
N 2.447378 -1.095306 -0.629171
N 2.263232 2.558842 0.347242
N 0.406089 3.699988 1.310748
C -1.150817 -1.580446 0.161600
C -1.875588 -1.124057 1.459257
C -2.971575 -0.125391 0.988350
C -2.934627 -0.140442 -0.557288
C -2.563906 1.185365 -1.237624
C 0.743851 0.252716 0.174999
C 1.323817 -1.809083 -0.501368
C 2.100651 0.202205 -0.206527
C 2.974092 1.391067 -0.127009
C 1.003999 2.558782 0.716051
C 2.246921 -3.887180 -1.169276
H -1.096769 -2.699656 0.047267
H -1.192374 -0.687345 2.225692
H -3.971160 -0.393221 1.392048
H -3.887827 -0.533059 -0.989015
H -1.493763 1.212074 -1.515046
H -2.825695 2.062649 -0.609574
H -3.026736 -2.761350 1.548075
H -2.893966 1.325867 2.366258
H -0.826682 1.422349 1.007516
H -3.067953 0.777725 -3.124803
H 1.812446 -4.882541 -1.310438
H 3.002437 -3.868399 -0.376417
H 2.645336 -3.470189 -2.101314
H -0.509133 3.960420 0.960339
H 1.032591 4.508281 1.354476


%chk=000259810-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259810

0 1
O -1.800616 -0.441774 -1.008255
O -2.512482 -2.416561 1.706477
O -2.291388 1.298366 1.429128
O -3.846254 0.929630 -2.543949
O 1.082509 -3.132202 -0.690343
O 4.495347 1.189374 0.018823
N 0.324789 -0.958882 -0.057949
N 0.362670 1.489059 0.505517
N 2.584623 -1.238420 -0.398134
N 2.573312 2.483379 0.448557
N 0.687503 3.788207 0.946974
C -1.079544 -1.316491 -0.051365
C -1.843049 -1.175406 1.319603
C -2.870420 -0.023838 1.092964
C -3.123132 -0.081009 -0.422149
C -3.590082 1.194444 -1.129306
C 0.943429 0.282287 0.164607
C 1.395774 -1.825573 -0.408183
C 2.317255 0.110034 -0.037215
C 3.240677 1.246776 0.135123
C 1.262520 2.567835 0.615992
C 2.253877 -3.968474 -1.049473
H -1.121728 -2.371813 -0.382377
H -1.154329 -0.966068 2.152441
H -3.784358 -0.198166 1.688318
H -3.849328 -0.894735 -0.640640
H -2.836485 1.992685 -0.988937
H -4.554007 1.531369 -0.713589
H -3.041009 -2.777458 0.948292
H -2.324086 1.431043 2.408807
H -0.642321 1.558877 0.753004
H -2.998248 0.628082 -2.960390
H 1.836423 -4.967320 -1.238259
H 2.974377 -3.981017 -0.214801
H 2.746370 -3.558516 -1.946999
H -0.308959 3.965816 0.845417
H 1.332268 4.571964 1.020669


