%chk=000229707.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229707

0 1
O -0.345752 -1.025362 -0.425655
O -0.010704 -0.567103 1.765083
C -2.717082 -0.563943 -0.799425
C -2.610993 0.863093 -0.211760
C -1.692057 -1.519697 -0.139659
C -4.117216 -1.156691 -0.562946
C -2.433496 -0.499357 -2.311683
C -2.848462 0.951279 1.301119
C -2.856783 2.401141 1.781860
C 0.400332 -0.542161 0.624733
C 1.711157 -0.042113 0.142660
C 2.605961 0.484348 1.088451
C 2.060788 -0.087000 -1.214951
C 3.848825 0.965296 0.671523
C 3.306075 0.395605 -1.624533
C 4.198042 0.920790 -0.682947
H -1.607946 1.271768 -0.447104
H -3.331270 1.520327 -0.735906
H -1.684838 -2.518845 -0.606322
H -1.837807 -1.610149 0.951874
H -4.354244 -1.227971 0.504800
H -4.217955 -2.156672 -0.995770
H -4.888897 -0.526680 -1.020049
H -3.093305 0.212011 -2.817030
H -1.397552 -0.188931 -2.498811
H -2.571625 -1.472839 -2.792133
H -2.055716 0.388104 1.841870
H -3.806135 0.464846 1.568472
H -1.907116 2.902450 1.562418
H -3.654573 2.982663 1.307859
H -3.008538 2.453804 2.865978
H 2.320250 0.512372 2.143706
H 1.355859 -0.500364 -1.940882
H 4.545630 1.374385 1.401716
H 3.581952 0.362179 -2.677354
H 5.169090 1.296618 -1.005600


%chk=000229707-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229707

0 1
O -0.315504 -0.966707 -0.473133
O 0.118466 -0.585213 1.794393
C -2.768462 -0.582806 -0.795935
C -2.725882 0.861577 -0.204822
C -1.679688 -1.483247 -0.161243
C -4.134153 -1.266984 -0.514162
C -2.545970 -0.500240 -2.329692
C -3.021896 1.011115 1.306041
C -2.921509 2.483683 1.763590
C 0.485265 -0.544283 0.592435
C 1.815245 -0.051834 0.123994
C 2.739407 0.400592 1.101551
C 2.169304 -0.026672 -1.250176
C 4.007680 0.874088 0.707823
C 3.439781 0.447906 -1.639249
C 4.360272 0.898666 -0.663002
H -1.728252 1.297422 -0.419020
H -3.456373 1.476647 -0.771388
H -1.709540 -2.493908 -0.607029
H -1.786466 -1.552465 0.935314
H -4.296982 -1.447010 0.564032
H -4.203108 -2.240785 -1.034963
H -4.961149 -0.630106 -0.878842
H -3.346365 0.097466 -2.804252
H -1.575797 -0.026414 -2.561997
H -2.553038 -1.506565 -2.790741
H -2.307327 0.404523 1.894401
H -4.037034 0.629942 1.531637
H -1.903424 2.880728 1.591181
H -3.631731 3.125176 1.207225
H -3.144320 2.586491 2.841482
H 2.443668 0.371130 2.155460
H 1.448871 -0.380522 -1.992650
H 4.719908 1.222487 1.463550
H 3.713654 0.466799 -2.699742
H 5.346346 1.266521 -0.968467


