%chk=000238813.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238813

0 1
O 2.362263 0.813771 0.501818
O 2.216167 -1.400311 0.143992
O -3.858850 0.160321 -0.285545
O 4.328857 0.854007 -0.628045
O 2.079852 -2.395260 -1.875386
O -4.326528 1.265456 1.661024
C 1.782088 -0.121711 -0.423309
C 0.290324 -0.011317 -0.318809
C -0.326135 0.608061 0.774704
C -0.486310 -0.566493 -1.353742
C -2.466890 0.152329 -0.199329
C -1.719452 0.701353 0.843414
C -1.873274 -0.487561 -1.304024
C 3.690467 1.209072 0.326878
C 2.378270 -2.477184 -0.708417
C 4.052319 2.082980 1.493816
C 2.944827 -3.622639 0.081772
C 4.931056 3.243043 1.048591
C 2.333035 -4.943328 -0.363085
C -6.113178 0.463471 0.167669
C -4.716829 0.720552 0.666047
C -6.982058 1.699244 0.353369
H 2.213901 -0.004112 -1.441184
H 0.289591 1.023009 1.577206
H 0.005885 -1.071807 -2.192284
H -2.202841 1.189588 1.693125
H -2.498249 -0.906205 -2.089993
H 4.577311 1.455090 2.249173
H 3.133591 2.451692 2.003263
H 2.784901 -3.456168 1.170892
H 4.049287 -3.630547 -0.060166
H -6.530919 -0.402368 0.729226
H -6.096077 0.147101 -0.900095
H 5.290005 3.819456 1.910092
H 4.390157 3.935774 0.390681
H 5.813289 2.891779 0.492833
H 2.824034 -5.791485 0.128978
H 2.430455 -5.086249 -1.449679
H 1.262765 -4.996654 -0.124969
H -6.644989 2.533981 -0.275219
H -8.026072 1.489597 0.088651
H -6.968946 2.051070 1.395666


%chk=000238813-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238813

0 1
O 2.257556 0.987481 0.446315
O 2.045159 -1.345071 0.378256
O -4.083428 0.362889 -0.478048
O 4.321305 0.502397 -0.548452
O 2.165852 -2.441181 -1.683830
O -4.667447 1.452699 1.532111
C 1.640958 -0.082387 -0.327822
C 0.143733 0.087847 -0.315363
C -0.529206 0.690757 0.772174
C -0.605564 -0.402610 -1.413831
C -2.664060 0.317624 -0.325188
C -1.935124 0.814898 0.782397
C -2.008027 -0.289980 -1.420034
C 3.654335 1.172876 0.262283
C 2.353247 -2.444459 -0.447764
C 4.147398 2.272382 1.182774
C 2.918539 -3.579434 0.387395
C 5.621533 2.639690 0.939112
C 3.058491 -4.890928 -0.405417
C -6.401596 0.761201 -0.095212
C -4.992663 0.922328 0.451734
C -7.473805 1.343054 0.841940
H 2.067408 -0.131994 -1.346034
H 0.052594 1.077826 1.613693
H -0.089939 -0.883471 -2.252305
H -2.450541 1.284259 1.620096
H -2.605970 -0.660717 -2.257346
H 3.988552 1.927593 2.223474
H 3.482298 3.147394 1.056154
H 2.274955 -3.704213 1.277868
H 3.901752 -3.243071 0.771769
H -6.569857 -0.317247 -0.280243
H -6.433555 1.240506 -1.092494
H 5.940158 3.426656 1.644691
H 5.774496 3.010720 -0.088788
H 6.276321 1.762210 1.074241
H 3.509911 -5.674311 0.228314
H 3.695496 -4.746980 -1.294234
H 2.075926 -5.250532 -0.756715
H -7.314559 2.422365 1.006318
H -8.478076 1.199946 0.406329
H -7.447455 0.851386 1.829281


