%chk=000182028.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182028

0 1
O 0.703455 1.744603 -1.369428
O 1.940292 1.245137 1.937148
O -1.257793 -0.961913 1.739863
O -1.963124 1.746732 -1.428898
O -2.397546 -1.078350 -1.994300
O -0.862815 -3.022063 1.129836
C 0.931372 -0.526924 -0.532381
C 0.631430 0.968945 -0.158328
C -0.746268 1.160536 0.525882
C 2.396492 -0.382647 -1.073713
C 1.955404 1.471892 0.516945
C 3.069936 0.571310 -0.055578
C -0.072043 -0.995840 -1.582756
C -1.859439 0.667672 -0.460043
C 0.934980 -1.454213 0.699103
C -0.833291 0.410831 1.873979
C -1.500044 -0.560786 -1.369401
C -0.952641 2.653940 0.826922
C 3.159525 -1.681182 -1.279442
C -3.215624 0.438184 0.182440
C -0.412475 -1.904396 1.169343
H 2.334543 0.150955 -2.059065
H 2.111486 2.546922 0.302646
H 3.556835 0.013520 0.767211
H 3.861433 1.167601 -0.536114
H -0.045410 -2.105381 -1.684897
H 0.234538 -0.627233 -2.591366
H 1.485119 -0.961507 1.538918
H 1.535884 -2.366259 0.467442
H 0.128742 0.443816 2.425603
H -1.642414 0.812388 2.516679
H -0.255096 3.020509 1.584050
H -0.804660 3.258193 -0.083807
H -1.973024 2.863252 1.169007
H 4.168867 -1.486420 -1.663587
H 3.275523 -2.256701 -0.352212
H 2.655147 -2.330285 -2.005923
H -0.183301 1.889296 -1.798871
H -3.184262 -0.383896 0.920694
H -3.585383 1.334426 0.690822
H -3.968384 0.135266 -0.561960
H 1.840419 2.085701 2.421772
H -2.732485 1.604771 -2.027232


%chk=000182028-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182028

0 1
O 0.704294 1.761950 -1.404475
O 2.001116 1.291533 2.026401
O -1.294276 -1.064715 1.676392
O -1.885510 1.700413 -1.592746
O -2.490801 -1.333222 -1.722934
O -0.683378 -3.208947 1.212652
C 0.949240 -0.533983 -0.516761
C 0.645660 0.963264 -0.154719
C -0.752638 1.161971 0.526891
C 2.407319 -0.384696 -1.085088
C 1.961095 1.461531 0.553522
C 3.085605 0.583758 -0.069520
C -0.086077 -1.023672 -1.552322
C -1.881558 0.678181 -0.475615
C 0.989546 -1.479939 0.734497
C -0.896926 0.357127 1.850559
C -1.542666 -0.660437 -1.241698
C -0.943497 2.658368 0.899851
C 3.205351 -1.671842 -1.355837
C -3.292576 0.615331 0.120931
C -0.352555 -2.008643 1.217594
H 2.291994 0.160945 -2.040337
H 2.074010 2.530021 0.298334
H 3.565017 0.018951 0.751898
H 3.866752 1.196495 -0.550290
H -0.047884 -2.116126 -1.712414
H 0.145128 -0.551037 -2.529243
H 1.515949 -0.975854 1.566267
H 1.566189 -2.380547 0.471220
H 0.034841 0.421266 2.435564
H -1.732059 0.769373 2.438349
H -0.280175 2.927175 1.743935
H -0.700893 3.312263 0.048498
H -1.979687 2.868473 1.215049
H 4.146916 -1.427777 -1.881613
H 3.483525 -2.204828 -0.428068
H 2.642746 -2.374409 -1.999313
H -0.229831 1.866709 -1.765282
H -3.351469 -0.149754 0.910550
H -3.592369 1.596197 0.525787
H -4.010149 0.314891 -0.663093
H 1.841629 2.163787 2.462507
H -2.633048 1.490856 -2.208875


