%chk=000181917.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181917

0 1
O 0.137735 0.364847 0.037390
O -1.606552 -0.188762 -1.366571
O 1.002652 -1.684490 -0.126689
O 3.921937 -0.991759 -1.329935
O 3.051665 1.680185 -1.506906
O -4.579079 0.018270 0.823987
O -3.495876 2.625746 1.083986
O -3.486883 -1.343081 -1.623038
O -0.577172 2.627080 0.725230
O -1.514432 -1.185583 1.457376
O -1.722063 -2.791956 -0.199030
C 2.489708 0.221372 0.281572
C 3.685049 -0.772067 0.067907
C 3.094458 1.586821 -0.066255
C 4.878515 -0.004690 0.667682
C 4.565419 1.488542 0.419972
C 1.295189 -0.290603 -0.496089
C -3.634266 0.522767 -0.129336
C -0.834215 0.885331 -0.908222
C -2.741101 1.464882 0.730252
C -2.765849 -0.669939 -0.625686
C -1.550780 1.998877 -0.092665
C 3.268496 -2.110528 0.586589
C 1.986641 -2.475239 0.437264
C -4.336121 1.222760 -1.279314
C -2.345336 -1.714729 0.471274
H 2.219868 0.237536 1.371309
H 2.536044 2.443698 0.356261
H 5.820875 -0.313158 0.181588
H 4.996746 -0.221449 1.742035
H 4.715635 2.079293 1.338722
H 5.249627 1.910455 -0.336579
H 1.349304 -0.261130 -1.599233
H -0.317927 1.248079 -1.823782
H -2.409840 0.936583 1.659407
H -1.890840 2.833293 -0.758156
H 4.027604 -2.761767 1.001860
H 4.003150 -0.128717 -1.814981
H 1.509998 -3.414747 0.711228
H -3.636263 1.475090 -2.088045
H -5.101640 0.580939 -1.737105
H -4.813031 2.154348 -0.942245
H -3.229188 -2.137976 1.001182
H 3.356330 2.557102 -1.809177
H -5.339974 -0.407703 0.367126
H -4.262634 2.348327 1.644738
H -2.979254 -2.153416 -1.923536
H -0.199883 1.981453 1.375622
H -0.608258 -0.929632 1.090201
H -0.814689 -2.537558 -0.524185


%chk=000181917-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181917

0 1
O 0.176921 0.472333 0.039866
O -1.657233 -0.287823 -1.352530
O 1.005379 -1.718190 -0.272795
O 3.997980 -0.629445 -1.604245
O 3.131771 1.910269 -1.195666
O -4.645381 0.185732 0.943831
O -3.591375 2.803750 0.842487
O -3.596089 -1.592668 -1.273586
O -0.717728 3.011994 0.200833
O -1.448525 -0.920171 1.690863
O -1.628655 -2.764449 0.120302
C 2.559862 0.092218 0.310988
C 3.755535 -0.799989 -0.147560
C 3.127394 1.518393 0.240766
C 4.925382 -0.189901 0.669279
C 4.576772 1.338253 0.802483
C 1.312408 -0.256955 -0.475920
C -3.669938 0.526014 -0.117260
C -0.870118 0.848424 -0.982100
C -2.784957 1.621089 0.553243
C -2.816647 -0.723437 -0.457721
C -1.650444 2.059496 -0.391605
C 3.386520 -2.245807 0.059875
C 2.080406 -2.605429 -0.016479
C -4.407755 1.040767 -1.368720
C -2.273440 -1.595626 0.740573
H 2.362779 -0.130272 1.378061
H 2.531330 2.252662 0.812038
H 5.880666 -0.365396 0.147988
H 4.986298 -0.660420 1.667280
H 4.616850 1.661270 1.858262
H 5.282444 1.974365 0.238883
H 1.425239 -0.096911 -1.562375
H -0.322871 1.142905 -1.893998
H -2.380382 1.193370 1.492285
H -2.103029 2.615989 -1.229281
H 4.151064 -3.010820 0.214001
H 3.927298 0.351823 -1.803870
H 1.698187 -3.622057 0.105212
H -3.724500 1.139368 -2.229396
H -5.190546 0.324328 -1.670096
H -4.859045 2.021642 -1.146471
H -3.133277 -1.987909 1.301542
H 3.370020 2.865314 -1.284951
H -5.350418 -0.382506 0.540182
H -4.342659 2.492621 1.412821
H -3.110577 -2.469016 -1.276872
H -0.207142 2.530721 0.902637
H -0.679964 -0.473976 1.219520
H -0.736312 -2.462939 -0.227602


