%chk=000179745.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179745

0 1
O 1.663024 0.379097 -2.506904
O 1.359701 -1.868046 -0.451817
O 3.516115 1.611678 1.387714
O 2.961478 -1.738929 1.696153
O -1.089276 2.016527 1.507580
O -2.932470 0.378729 0.210701
O -4.863019 -0.045031 -0.888556
C 1.500186 0.960135 0.033860
C 2.188787 0.271941 -1.162988
C 0.138667 0.217045 0.300770
C 2.553746 -1.115535 -0.604789
C 2.522778 0.616371 1.179646
C 2.982733 0.958050 -2.234847
C 3.225790 -0.712927 0.744071
C 0.388058 -1.315979 0.490304
C 1.319699 2.456993 -0.142432
C -0.822853 0.446723 -0.881528
C -0.509310 0.713746 1.626223
C -2.124636 -0.346493 -0.795579
C -0.810642 -2.185464 0.245799
C -1.953617 -1.768475 -0.313842
C -3.108742 -2.685774 -0.539108
C -4.298377 0.461275 0.051360
C -4.865119 1.245890 1.181477
H 3.169087 -1.762107 -1.256740
H 2.042318 0.531585 2.179170
H 3.016904 2.042148 -2.306948
H 3.801920 0.447771 -2.736228
H 4.318987 -0.568491 0.632310
H 0.809743 -1.518575 1.509084
H 2.262054 3.008892 -0.051455
H 0.875190 2.698769 -1.115668
H 0.641632 2.868502 0.630679
H -0.311371 0.161289 -1.833353
H -1.050205 1.528131 -0.977333
H 0.240402 0.848593 2.429877
H -1.298641 0.010536 1.957682
H -2.683536 -0.312376 -1.762212
H -0.659498 -3.228011 0.533653
H 3.817551 2.002528 0.539908
H 3.596083 -1.671975 2.443333
H -1.888057 1.964361 0.921878
H -3.326446 -3.300972 0.344083
H -2.902248 -3.376793 -1.370939
H -4.038132 -2.151348 -0.797317
H -5.288682 2.198460 0.824446
H -4.117521 1.481148 1.957093
H -5.685834 0.692390 1.666527


%chk=000179745-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179745

0 1
O 1.660688 0.591294 -2.581824
O 1.352066 -1.870175 -0.585500
O 3.607721 1.548432 1.507336
O 3.387896 -1.903769 1.411636
O -1.280793 1.864184 1.617183
O -3.108726 0.379695 0.205932
O -4.841043 0.067651 -1.334808
C 1.548845 0.964717 0.054174
C 2.197219 0.344927 -1.208349
C 0.181125 0.189822 0.356630
C 2.566236 -1.076186 -0.780815
C 2.635478 0.516941 1.128818
C 3.027463 1.105653 -2.199368
C 3.345142 -0.748517 0.522392
C 0.466958 -1.340612 0.499505
C 1.331202 2.485210 -0.041903
C -0.829711 0.380185 -0.808903
C -0.434592 0.675628 1.721026
C -2.133049 -0.421413 -0.666618
C -0.773947 -2.199239 0.442023
C -1.975184 -1.801062 -0.056948
C -3.191708 -2.701552 -0.074654
C -4.426038 0.556231 -0.263775
C -5.216249 1.408791 0.705891
H 3.157464 -1.643260 -1.515616
H 2.171606 0.255834 2.092386
H 3.095991 2.198637 -2.138287
H 3.861611 0.600819 -2.704634
H 4.376014 -0.443423 0.234190
H 0.991031 -1.534515 1.459985
H 2.280470 3.042846 0.046637
H 0.875427 2.741210 -1.016042
H 0.654561 2.843755 0.749185
H -0.354383 0.036242 -1.743016
H -1.074301 1.446748 -0.948455
H 0.361233 0.964246 2.427604
H -1.008680 -0.158074 2.175704
H -2.639365 -0.501138 -1.647797
H -0.653957 -3.227853 0.804560
H 4.020645 1.930540 0.691157
H 3.977211 -1.685944 2.177932
H -2.127466 1.570958 1.176306
H -2.948301 -3.713100 0.291996
H -3.609122 -2.786593 -1.095401
H -4.001292 -2.294314 0.561338
H -4.831084 2.444389 0.700935
H -5.112502 1.023090 1.734001
H -6.275410 1.418067 0.411049


