%chk=000229097.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229097

0 1
O 0.037802 1.538340 -1.715229
O 0.353203 2.030661 1.814875
O -0.458560 3.373345 0.220457
C -0.015748 1.020741 -0.379369
C -1.294447 0.218155 -0.204168
C 1.268259 0.239623 -0.190913
C -1.273077 -1.179178 -0.309500
C 1.569565 -0.328213 1.056976
C -2.520055 0.871415 0.003253
C 2.154836 0.070373 -1.262877
C -0.063310 2.275643 0.537360
C -3.676812 -1.263517 0.028257
C 3.635342 -1.230863 0.155342
C -2.453415 -1.915289 -0.190247
C 2.743668 -1.059479 1.228424
C -3.699842 0.138508 0.122835
C 3.331350 -0.661134 -1.090684
C -4.937917 -2.049718 0.172315
C 4.887222 -2.025371 0.336672
H -0.330443 -1.701183 -0.490593
H 0.886218 -0.184231 1.897979
H -2.563709 1.960700 0.071664
H 1.920635 0.516083 -2.234658
H -2.420600 -3.000364 -0.270446
H 2.970404 -1.495284 2.199061
H -4.642328 0.657214 0.289044
H 4.013739 -0.786039 -1.928903
H -0.737832 2.123994 -1.897959
H -5.820505 -1.492684 -0.170416
H -4.912929 -2.989133 -0.396630
H -5.111988 -2.314730 1.226464
H 5.697608 -1.683300 -0.321268
H 5.268691 -1.975592 1.365372
H 4.710133 -3.086886 0.107201
H 0.324942 2.846791 2.388411


%chk=000229097-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229097

0 1
O -0.101989 1.868270 -1.418356
O -0.348252 1.670207 2.226269
O 0.185429 3.390094 0.769820
C -0.045325 1.109875 -0.162146
C -1.319003 0.240888 -0.108563
C 1.270994 0.295119 -0.093635
C -1.332570 -1.048535 0.468911
C 1.845434 -0.155446 1.120133
C -2.525945 0.767921 -0.631460
C 1.904684 -0.046773 -1.313956
C -0.055586 2.176160 0.969499
C -3.744821 -1.276510 0.007322
C 3.677946 -1.262532 -0.106117
C -2.531245 -1.793670 0.524864
C 3.033135 -0.921143 1.108415
C -3.718776 0.019336 -0.571244
C 3.087302 -0.814061 -1.316415
C -5.025485 -2.092684 0.040946
C 4.968807 -2.062619 -0.116018
H -0.410824 -1.480576 0.869802
H 1.368155 0.083470 2.075855
H -2.512130 1.753300 -1.106858
H 1.458319 0.300776 -2.250039
H -2.521321 -2.794179 0.974436
H 3.463006 -1.258738 2.059480
H -4.643198 0.443239 -0.983084
H 3.560078 -1.070170 -2.272865
H 0.337302 2.748659 -1.257010
H -5.190442 -2.613307 -0.922563
H -4.993970 -2.863462 0.830749
H -5.908491 -1.453607 0.220971
H 5.845944 -1.401158 -0.255422
H 5.114566 -2.609102 0.831888
H 4.982233 -2.798017 -0.940551
H -0.333863 2.408374 2.895044


