%chk=000116426.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116426

0 1
O -0.704804 -0.452926 0.454080
O -2.973357 0.447721 2.180903
O -2.389403 0.419635 -2.276596
O 2.627951 -1.651427 2.205018
C -2.027712 -0.027243 -0.005548
C -2.930564 -0.523243 1.136291
C -2.320644 -0.688631 -1.357318
C 0.424127 0.146823 -0.060633
C 1.619383 -0.275517 0.563050
C 0.425211 1.079441 -1.106116
C 2.829203 0.278841 0.113761
C 1.645441 1.611187 -1.523587
C 2.846273 1.216873 -0.918217
C 1.612640 -1.272461 1.658119
H -2.056279 1.086940 -0.089935
H -2.582357 -1.494534 1.535960
H -3.990488 -0.595642 0.820215
H -3.287360 -1.222074 -1.380409
H -1.506933 -1.376749 -1.654994
H -0.504405 1.378283 -1.597417
H 3.758931 -0.044106 0.595350
H 1.662529 2.342479 -2.333908
H 3.790001 1.641308 -1.253687
H -2.086160 0.534874 2.598398
H -2.426273 0.093125 -3.198480
H 0.619947 -1.654277 1.949000


%chk=000116426-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116426

0 1
O -0.725636 -0.450258 0.488424
O -2.732270 0.182681 2.356570
O -2.435300 0.450517 -2.364533
O 2.734729 -1.488869 2.395136
C -2.059340 -0.025645 -0.021153
C -3.024456 -0.470074 1.086436
C -2.393064 -0.652973 -1.389014
C 0.443575 0.133295 -0.029723
C 1.663743 -0.219700 0.628256
C 0.451790 1.015800 -1.137387
C 2.881321 0.345785 0.162647
C 1.679418 1.561867 -1.571765
C 2.897955 1.235686 -0.926102
C 1.682421 -1.155716 1.777989
H -2.077931 1.077432 -0.111711
H -2.994845 -1.577439 1.182871
H -4.049532 -0.160815 0.821880
H -3.378009 -1.163196 -1.346237
H -1.618459 -1.401977 -1.649002
H -0.473774 1.253530 -1.671368
H 3.799227 0.060156 0.688736
H 1.680869 2.246368 -2.427689
H 3.840573 1.668624 -1.275506
H -1.780930 0.005369 2.574707
H -2.630677 0.098258 -3.268162
H 0.693500 -1.570005 2.078998


