%chk=000220021.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220021

0 1
O -0.000069 3.320452 0.000136
O -2.239090 3.057229 -0.000027
O 2.238962 3.057311 0.000221
C -1.441733 -0.063128 0.000301
C 1.441722 -0.063073 0.000524
C -0.710383 -1.319004 0.000481
C 0.710420 -1.318977 0.000597
C -0.720736 1.095662 0.000239
C 0.720681 1.095689 0.000336
C -2.922344 -0.065362 0.000223
C 2.922332 -0.065251 0.000625
C -1.402647 -2.565039 0.000553
C 1.402731 -2.564985 0.000813
C -1.179734 2.512835 0.000105
C 1.179623 2.512882 0.000177
C -0.709236 -3.754708 0.000729
C 0.709366 -3.754680 0.000861
C -3.620432 -0.064120 1.216736
C 3.620454 -0.066462 -1.215865
C -3.620312 -0.064529 -1.216359
C 3.620268 -0.061913 1.217226
C -5.017883 -0.063630 1.211815
C 5.017907 -0.065899 -1.210909
C -5.017764 -0.064037 -1.211576
C 5.017718 -0.061392 1.212478
C -5.716700 -0.064385 0.000085
C 5.716689 -0.064172 0.000837
H -2.495625 -2.561600 0.000475
H 2.495709 -2.561505 0.000963
H -1.239974 -4.707252 0.000782
H 1.240140 -4.707204 0.001003
H -3.076000 -0.054496 2.159977
H 3.076047 -0.058778 -2.159139
H -3.075788 -0.055219 -2.159550
H 3.075718 -0.050701 2.160381
H -5.562927 -0.055292 2.155024
H 5.562973 -0.059454 -2.154119
H -5.562714 -0.056018 -2.154842
H 5.562646 -0.051439 2.155739
H -6.805864 -0.058254 0.000031
H 6.805853 -0.058002 0.000913


%chk=000220021-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220021

0 1
O -0.000071 3.360086 0.000526
O -2.321792 3.014976 0.000486
O 2.321663 3.015066 0.000419
C -1.469016 -0.068636 0.000421
C 1.469006 -0.068579 0.000558
C -0.728481 -1.315764 0.000324
C 0.728518 -1.315736 0.000408
C -0.716842 1.106676 0.000624
C 0.716786 1.106704 0.000713
C -2.969656 -0.061144 0.000303
C 2.969645 -0.061031 0.000654
C -1.417282 -2.572696 0.000212
C 1.417367 -2.572642 0.000468
C -1.190069 2.518680 0.000648
C 1.189958 2.518727 0.000679
C -0.713747 -3.780093 0.000230
C 0.713878 -3.780066 0.000386
C -3.686675 -0.061666 1.223316
C 3.686681 -0.065022 -1.222347
C -3.686489 -0.061779 -1.222819
C 3.686461 -0.058145 1.223778
C -5.099079 -0.054847 1.222464
C 5.099089 -0.058092 -1.221498
C -5.098894 -0.054957 -1.222180
C 5.098862 -0.051331 1.223137
C -5.809351 -0.051442 0.000089
C 5.809339 -0.051226 0.000875
H -2.511236 -2.571653 0.000137
H 2.511321 -2.571557 0.000633
H -1.256925 -4.731092 0.000165
H 1.257092 -4.731044 0.000472
H -3.139220 -0.056007 2.172695
H 3.139238 -0.062105 -2.171747
H -3.138892 -0.056210 -2.172115
H 3.138853 -0.049873 2.173046
H -5.642452 -0.046051 2.173742
H 5.642475 -0.051951 -2.172789
H -5.642124 -0.046249 -2.173540
H 5.642078 -0.039927 2.174477
H -6.904880 -0.040228 0.000005
H 6.904869 -0.039972 0.000946


