%chk=000187145.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187145

0 1
O 0.609779 0.239597 0.015580
O -4.691347 -1.333067 -0.064672
O -0.119256 -3.800675 -0.208083
C -0.696257 -0.248055 -0.007089
C -1.701502 0.782863 0.060995
C -0.997376 -1.591320 -0.085184
C -3.058645 0.375984 0.037985
C -3.346834 -1.040214 -0.048044
C -2.364670 -1.997025 -0.106444
C 1.645901 -0.688915 -0.048735
C 0.091325 -2.606739 -0.147204
C -1.385472 2.167458 0.151107
C 1.436596 -2.017237 -0.128743
C -4.084221 1.359903 0.101190
C 2.931589 0.031296 -0.020886
C -2.395176 3.102129 0.211979
C -3.756058 2.694933 0.185832
C 4.013635 -0.504503 0.697060
C 3.076265 1.245072 -0.712656
C 5.235830 0.171329 0.712700
C 4.302452 1.913547 -0.692147
C 5.381605 1.377489 0.018550
H -2.577085 -3.065455 -0.169134
H -0.334739 2.461336 0.173653
H 2.262020 -2.727248 -0.196956
H -5.124346 1.024985 0.081129
H -2.163954 4.164734 0.282059
H -4.535431 3.455256 0.234781
H 3.898889 -1.441875 1.243125
H 2.229233 1.658861 -1.262387
H -4.850964 -2.309984 -0.122611
H 6.077044 -0.242863 1.267917
H 4.417408 2.853312 -1.231180
H 6.337762 1.900491 0.032314


%chk=000187145-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187145

0 1
O 0.604519 0.277324 0.018539
O -4.764623 -1.398247 -0.005723
O -0.142575 -3.826455 0.064299
C -0.720092 -0.193644 0.013362
C -1.750120 0.808821 -0.003204
C -1.014898 -1.565582 0.029708
C -3.125112 0.367579 -0.011109
C -3.405218 -1.051601 0.002485
C -2.379982 -1.990097 0.023810
C 1.668862 -0.637015 0.034127
C 0.082917 -2.567756 0.049284
C -1.466979 2.210477 -0.010560
C 1.428598 -1.996242 0.043491
C -4.171321 1.339534 -0.030350
C 2.985151 0.036168 0.027797
C -2.509341 3.142519 -0.028905
C -3.868792 2.705551 -0.039956
C 4.177932 -0.696473 0.282501
C 3.082033 1.430862 -0.235412
C 5.430755 -0.052826 0.265110
C 4.337800 2.071457 -0.250820
C 5.518371 1.334043 -0.002626
H -2.559618 -3.072067 0.036031
H -0.424219 2.539327 0.003142
H 2.263640 -2.699664 0.031181
H -5.206848 0.988958 -0.036681
H -2.284291 4.214367 -0.033433
H -4.676448 3.445139 -0.054513
H 4.130830 -1.766170 0.510233
H 2.170555 2.000977 -0.433575
H -4.876327 -2.381008 0.004453
H 6.339161 -0.630617 0.466454
H 4.395962 3.145360 -0.458781
H 6.493719 1.832401 -0.014558


