%chk=000228230.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228230

0 1
O 2.322438 0.065335 0.856197
O 2.966427 1.364077 -0.878237
C -2.487987 0.375261 0.284848
C -1.230697 0.970287 0.768362
C 1.226374 0.982688 1.156324
C -0.041017 0.370752 0.653340
C -2.789628 -0.975220 0.525263
C -3.405215 1.176438 -0.417679
C -3.992817 -1.516516 0.064506
C -4.602923 0.627204 -0.879711
C -4.899983 -0.718830 -0.639276
C 4.162143 -0.709899 -0.394196
C 3.126087 0.357759 -0.228075
C 3.751253 -2.089724 -0.014237
C 5.361053 -0.371105 -0.872635
H -1.337513 1.957222 1.225831
H 1.434430 1.975535 0.707185
H 1.267388 1.042005 2.261274
H 0.082888 -0.607363 0.181616
H -2.088691 -1.598503 1.077212
H -3.177403 2.223404 -0.609312
H -4.223288 -2.563480 0.254942
H -5.308069 1.249305 -1.428813
H -5.835056 -1.142973 -0.998822
H 3.282064 -2.104189 0.984551
H 3.009359 -2.491587 -0.720893
H 4.596514 -2.789788 0.007718
H 6.161830 -1.082545 -1.024083
H 5.625639 0.642551 -1.154199


%chk=000228230-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228230

0 1
O 2.337208 -0.213122 1.280992
O 2.309056 1.339105 -0.466449
C -2.271213 0.267374 0.101118
C -0.958208 0.693467 0.622946
C 1.190698 0.533845 1.923351
C -0.127693 -0.009045 1.446856
C -2.894592 -0.961900 0.463569
C -2.953961 1.123553 -0.808712
C -4.148496 -1.319150 -0.069758
C -4.209879 0.766702 -1.343825
C -4.813661 -0.457645 -0.976725
C 3.870541 -0.564558 -0.523206
C 2.779036 0.294572 0.050332
C 4.296979 -1.807102 0.230162
C 4.416251 -0.167879 -1.706130
H -0.616216 1.684895 0.290904
H 1.299516 1.606198 1.687445
H 1.358021 0.350674 2.997437
H -0.384078 -1.021773 1.784702
H -2.398958 -1.638799 1.168256
H -2.487039 2.072926 -1.099105
H -4.613113 -2.268257 0.220656
H -4.715991 1.440145 -2.044356
H -5.789351 -0.738133 -1.388680
H 4.654917 -1.552973 1.243881
H 3.446308 -2.499135 0.364179
H 5.102024 -2.334189 -0.309552
H 5.214855 -0.743078 -2.187062
H 4.062639 0.741384 -2.204224


