%chk=000221677.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221677

0 1
O 1.340518 1.050200 -0.615896
O 1.045861 -1.264810 -0.933930
C 0.442469 0.031785 -1.070179
C 2.684325 -0.473102 0.698891
C 1.930211 0.860400 0.701013
C 1.741382 -1.610198 0.283146
C -0.901913 0.101914 -0.360803
C 0.335844 0.246036 -2.576380
C 2.837292 2.071048 0.860799
C 0.765050 -2.014085 1.381245
C -1.744228 -1.017825 -0.360913
C -1.328013 1.297340 0.230210
C -3.000427 -0.946316 0.246549
C -2.584732 1.366179 0.838525
C -3.420403 0.244777 0.848797
H 3.524008 -0.417898 -0.023788
H 3.136747 -0.673429 1.684715
H 1.104982 0.858793 1.447384
H 2.319794 -2.496978 -0.075237
H 1.186322 0.845505 -2.934736
H 0.369328 -0.718330 -3.102769
H -0.586226 0.765493 -2.855922
H 3.555239 2.139843 0.031673
H 2.255025 3.001360 0.841626
H 3.399806 2.035140 1.798382
H 0.167481 -1.167690 1.741971
H 0.053033 -2.762794 1.010720
H 1.285208 -2.444935 2.242308
H -1.406298 -1.940969 -0.835082
H -0.674728 2.171710 0.205247
H -3.653546 -1.816648 0.247940
H -2.913916 2.295018 1.300007
H -4.399197 0.299567 1.321486


%chk=000221677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221677

0 1
O 1.362246 1.091789 -0.678566
O 1.074907 -1.315004 -0.992793
C 0.452929 0.020693 -1.110669
C 2.720555 -0.442970 0.663780
C 1.935276 0.880419 0.680199
C 1.807381 -1.627695 0.271623
C -0.898853 0.098866 -0.369089
C 0.264839 0.231534 -2.617647
C 2.801604 2.106874 0.963860
C 0.884866 -2.101025 1.413662
C -1.762436 -1.024162 -0.345465
C -1.346843 1.323402 0.185186
C -3.042405 -0.932058 0.243457
C -2.625726 1.415911 0.780031
C -3.477876 0.288154 0.812550
H 3.539395 -0.347098 -0.073508
H 3.168958 -0.635057 1.657768
H 1.102378 0.823179 1.413231
H 2.435199 -2.481800 -0.041841
H 1.248760 0.191099 -3.111849
H -0.383287 -0.559275 -3.029478
H -0.201404 1.212783 -2.805647
H 3.605540 2.190876 0.211232
H 2.195671 3.028755 0.923410
H 3.262177 2.032673 1.965905
H 0.263096 -1.289853 1.827690
H 0.210661 -2.897228 1.055400
H 1.503582 -2.516519 2.232008
H -1.416419 -1.967538 -0.782306
H -0.688565 2.197971 0.136260
H -3.699990 -1.808889 0.257940
H -2.958723 2.367376 1.210583
H -4.471195 0.359917 1.270080


