%chk=000112036.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000112036

0 1
O -1.322000 -2.276591 -0.194327
O 3.625112 -0.322332 -0.332290
O 2.458164 0.700656 1.313894
C -1.188667 -0.018892 -0.949939
C -2.304758 1.023916 -1.121446
C -2.872664 1.509204 0.216993
C -3.406864 0.333595 1.043384
C 0.126653 0.612820 -0.462332
C -2.317335 -0.710255 1.298379
C -1.604755 -1.119255 0.030307
C 1.300841 -0.365600 -0.572090
C 2.455499 0.087427 0.272641
C 4.865198 -0.027420 0.363371
H -1.006312 -0.502269 -1.945284
H -3.118744 0.582830 -1.731962
H -1.926782 1.884654 -1.706371
H -3.681512 2.243139 0.037821
H -2.093632 2.051414 0.787499
H -4.262320 -0.139156 0.520837
H -3.806448 0.697556 2.009829
H 0.020598 0.965043 0.586909
H 0.343300 1.523974 -1.055388
H -2.746487 -1.607450 1.791383
H -1.562309 -0.316563 2.012545
H 1.615502 -0.497296 -1.630430
H 1.001790 -1.392285 -0.245412
H 4.872849 1.013900 0.702555
H 5.623588 -0.214943 -0.403735
H 4.963397 -0.712221 1.210960


%chk=000112036-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000112036

0 1
O -1.430128 -2.356548 -0.335621
O 3.693689 -0.407616 -0.328109
O 2.513087 0.888612 1.203885
C -1.223045 -0.004957 -0.972516
C -2.351201 1.060016 -1.107985
C -2.914133 1.522108 0.256514
C -3.437018 0.314324 1.066698
C 0.111220 0.618380 -0.453168
C -2.325740 -0.751773 1.271600
C -1.653265 -1.148756 -0.042159
C 1.304960 -0.354092 -0.568348
C 2.518776 0.130694 0.205729
C 4.944962 -0.056938 0.387968
H -1.024226 -0.456142 -1.964528
H -3.180173 0.628525 -1.704960
H -1.962253 1.924830 -1.680662
H -3.731968 2.249632 0.093505
H -2.130795 2.049672 0.836006
H -4.288849 -0.147425 0.528282
H -3.818413 0.640227 2.052570
H 0.016426 0.949482 0.596704
H 0.320255 1.529266 -1.047584
H -2.713229 -1.664763 1.755731
H -1.545964 -0.327961 1.938974
H 1.593013 -0.527199 -1.620003
H 1.030091 -1.349674 -0.164720
H 5.090623 1.036353 0.389831
H 5.741140 -0.563498 -0.175035
H 4.903058 -0.417181 1.429699


