%chk=000179443.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179443

0 1
O 0.419412 -0.192273 1.477665
O 4.649656 -1.973781 0.283500
O 4.898044 0.084329 -1.725313
O -5.034805 1.614240 -0.410236
O -5.454270 -1.008351 -0.804358
C 0.357386 1.657369 -0.144524
C -0.434464 0.925764 0.992183
C 1.619348 0.842026 -0.239241
C 1.573497 -0.200583 0.720911
C -1.741620 0.347567 0.519345
C 0.615115 3.120087 0.197902
C 2.720631 0.956461 -1.068560
C 2.585592 -1.132217 0.888891
C -2.806129 1.235956 0.267942
C -1.905532 -1.024581 0.334274
C 3.764706 0.025369 -0.924176
C 3.707861 -1.009785 0.041460
C -4.021066 0.720734 -0.170799
C -3.131182 -1.551337 -0.106917
C -4.185221 -0.682914 -0.360279
C 5.862292 -1.963522 -0.515804
C -5.756389 -2.414575 -0.970229
H -0.210631 1.595092 -1.105364
H -0.564880 1.545028 1.905169
H -0.320051 3.676412 0.328124
H 1.201689 3.226109 1.119862
H 1.183744 3.615568 -0.598793
H 2.783347 1.744381 -1.814174
H 2.538112 -1.923053 1.632630
H -2.699750 2.309881 0.409486
H -1.070965 -1.699319 0.542160
H -3.235051 -2.624232 -0.242850
H 4.833465 0.835800 -2.361911
H -5.862139 1.141464 -0.706634
H 6.403102 -1.023535 -0.363808
H 5.614817 -2.104691 -1.573141
H 6.407091 -2.820270 -0.104662
H -5.660121 -2.938270 -0.014461
H -5.114134 -2.849630 -1.741740
H -6.803007 -2.381119 -1.299631


%chk=000179443-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179443

0 1
O 0.467098 -0.691826 0.969296
O 5.129503 -1.942624 0.237318
O 5.335920 0.179451 -1.691480
O -5.151140 1.559836 1.143509
O -5.898908 -0.631412 -0.199519
C 0.386050 1.130307 -0.684912
C -0.330956 0.533799 0.583507
C 1.778954 0.523796 -0.561624
C 1.738159 -0.529847 0.376755
C -1.782978 0.158759 0.391827
C 0.317456 2.668894 -0.730056
C 2.974339 0.783150 -1.251159
C 2.855377 -1.325279 0.664229
C -2.798059 1.014529 0.887362
C -2.141314 -1.010377 -0.320474
C 4.118509 -0.013479 -0.993123
C 4.065010 -1.064129 -0.027868
C -4.150542 0.711880 0.657264
C -3.500895 -1.328815 -0.544913
C -4.503189 -0.464999 -0.061886
C 6.454141 -1.354671 0.527611
C -6.372362 -1.824265 -0.902952
H -0.111298 0.725175 -1.590945
H -0.224413 1.251195 1.423069
H -0.733354 3.012036 -0.749150
H 0.814898 3.111735 0.152166
H 0.813863 3.063438 -1.635359
H 3.027242 1.586794 -1.998237
H 2.826418 -2.134410 1.397265
H -2.555052 1.915893 1.460129
H -1.356355 -1.687616 -0.670747
H -3.763024 -2.242825 -1.086536
H 5.225660 0.883471 -2.376955
H -6.033844 1.174096 0.897531
H 6.392977 -0.686357 1.408563
H 6.840785 -0.798440 -0.341223
H 7.098762 -2.216883 0.757104
H -6.047912 -2.745249 -0.381984
H -6.008108 -1.837373 -1.948026
H -7.469916 -1.755757 -0.891475


