%chk=000257311.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257311

0 1
O 1.993548 -1.322066 0.605634
O 2.454591 0.931908 0.293907
O -1.559970 1.340721 0.531718
O 0.385605 -2.660775 -0.171080
O -0.981837 0.072909 -1.252062
C -0.239898 -0.548415 1.023543
C 0.751959 0.343874 1.801268
C 2.143133 -0.032351 1.272786
C -1.295403 -1.193976 1.943191
C 0.655216 -1.636617 0.382060
C -0.938685 0.267236 -0.064944
C -2.297270 -2.054846 1.184655
C 3.682360 0.683600 -0.465145
C -2.326291 2.247366 -0.327360
C 3.681789 1.780870 -1.509607
C -3.650588 1.612808 -0.694406
H 0.682261 0.188423 2.891931
H 0.549020 1.425555 1.637174
H 2.957733 -0.187877 1.998922
H -1.830263 -0.384945 2.486295
H -0.784352 -1.804382 2.715375
H -2.931693 -1.461292 0.515206
H -1.795595 -2.813479 0.560438
H -2.959827 -2.591306 1.873392
H 4.533648 0.748408 0.232141
H 3.615074 -0.328958 -0.904188
H -2.428599 3.122087 0.340453
H -1.711333 2.494031 -1.211408
H 4.551650 1.702552 -2.171326
H 2.776468 1.728874 -2.133015
H 3.688448 2.776749 -1.047779
H -4.308619 2.325103 -1.206436
H -3.506761 0.755474 -1.370435
H -4.182116 1.242740 0.191402


%chk=000257311-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257311

0 1
O 2.068769 -1.429237 0.683292
O 2.231164 0.952260 0.253944
O -1.423910 1.270292 0.535893
O 0.382576 -2.904587 0.084216
O -0.696931 -0.096172 -1.209044
C -0.192980 -0.694955 1.162890
C 0.815274 0.128977 2.015398
C 2.148240 -0.043787 1.275472
C -1.355531 -1.283020 2.025141
C 0.705331 -1.808894 0.557318
C -0.767656 0.156548 0.011060
C -2.458615 -2.007572 1.225830
C 3.445151 0.852347 -0.599693
C -2.054773 2.197166 -0.457378
C 3.398953 2.018584 -1.582276
C -3.457146 1.716062 -0.838087
H 0.889555 -0.313233 3.024697
H 0.534314 1.188100 2.100717
H 3.058342 -0.073115 1.904721
H -1.795200 -0.442915 2.595146
H -0.907127 -1.980854 2.759100
H -2.976102 -1.316206 0.535861
H -2.038010 -2.835606 0.632260
H -3.216369 -2.419147 1.916691
H 4.343761 0.898548 0.052598
H 3.433533 -0.123474 -1.119428
H -2.074546 3.163712 0.070893
H -1.395739 2.257620 -1.341032
H 4.280572 1.989154 -2.247978
H 2.490063 1.958290 -2.204936
H 3.394901 2.984275 -1.047934
H -3.933986 2.456576 -1.506923
H -3.409192 0.752787 -1.372857
H -4.093282 1.601479 0.056730


