%chk=000289608.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289608

0 1
O 5.686617 -0.534911 -0.511981
O 1.040424 1.474028 0.754172
O 6.208011 1.439774 -1.413184
O -7.474710 0.297579 -0.671566
O -6.734385 -0.837367 1.139259
C 3.653414 0.012924 0.716992
C 2.372483 -0.388023 -0.077636
C 4.692910 -1.120018 0.386025
C 2.469000 -1.916224 -0.269955
C 3.967662 -2.237679 -0.364725
C 4.297604 1.289987 0.138645
C 1.036361 0.041285 0.561146
C 3.445175 0.116849 2.223961
C 5.473741 0.829241 -0.687108
C -0.162210 -0.190082 -0.370876
C -1.488744 -0.080278 0.390867
C -2.689389 -0.239737 -0.550637
C -4.010145 -0.152878 0.223121
C -5.213931 -0.288528 -0.716087
C -6.496548 -0.341669 0.064406
C -8.812450 0.323375 -0.108410
H 2.431451 0.096483 -1.085685
H 5.279739 -1.469329 1.254038
H 2.007865 -2.454103 0.577816
H 1.929419 -2.242951 -1.174945
H 4.310960 -2.260259 -1.419852
H 4.203249 -3.232044 0.048657
H 3.589457 1.883053 -0.475991
H 4.643730 1.990215 0.923507
H 0.884953 -0.442447 1.550746
H 3.014149 -0.804534 2.636541
H 2.769883 0.944383 2.487215
H 4.389207 0.296605 2.755050
H -0.082828 -1.174729 -0.866495
H -0.133455 0.571132 -1.179765
H -1.533192 -0.840895 1.193552
H -1.532320 0.905624 0.900295
H 1.716080 1.728146 1.419286
H -2.625653 -1.207423 -1.084792
H -2.657285 0.542401 -1.334720
H -4.054248 -0.943628 1.001721
H -4.068304 0.808743 0.771750
H -5.240398 0.546331 -1.450340
H -5.135007 -1.215016 -1.326424
H -8.775553 0.625742 0.943690
H -9.323459 1.065656 -0.730097
H -9.256631 -0.671106 -0.209990


%chk=000289608-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289608

0 1
O 5.422084 -0.227147 -1.012376
O 1.043148 1.442587 0.828157
O 5.555250 1.978962 -1.723564
O -7.596323 0.250585 -0.901277
O -6.800395 -0.316653 1.212108
C 3.729505 -0.021990 0.740048
C 2.421820 -0.469459 -0.014076
C 4.811220 -0.981081 0.130370
C 2.576199 -2.008981 -0.146221
C 4.093858 -2.244247 -0.397829
C 4.211695 1.384443 0.305763
C 1.084658 -0.028554 0.625916
C 3.655003 -0.210180 2.272020
C 5.116517 1.151136 -0.910953
C -0.134685 -0.351220 -0.254972
C -1.481289 -0.041989 0.433609
C -2.695603 -0.291711 -0.487804
C -4.042141 -0.021581 0.217917
C -5.248694 -0.230977 -0.721373
C -6.582949 -0.111943 -0.004042
C -8.958365 0.352966 -0.322230
H 2.463777 -0.027762 -1.032691
H 5.635659 -1.199047 0.832766
H 2.253298 -2.503354 0.792019
H 1.958440 -2.423792 -0.960351
H 4.310874 -2.337160 -1.476286
H 4.464005 -3.160904 0.092653
H 3.389387 2.063075 0.025359
H 4.813459 1.884035 1.089842
H 0.965933 -0.539748 1.609006
H 3.393886 -1.249794 2.542482
H 2.905527 0.449367 2.748781
H 4.631086 0.022977 2.736220
H -0.101266 -1.420815 -0.541305
H -0.047972 0.239694 -1.189188
H -1.580855 -0.667561 1.345858
H -1.473663 1.011975 0.768747
H 1.628361 1.684318 1.589235
H -2.675865 -1.340865 -0.852866
H -2.609064 0.353371 -1.387029
H -4.149990 -0.683662 1.097623
H -4.054759 1.015540 0.607138
H -5.235610 0.476733 -1.569397
H -5.204221 -1.247000 -1.166231
H -8.980885 1.124258 0.465947
H -9.602719 0.630751 -1.168004
H -9.264638 -0.613898 0.111680


