%chk=000180514.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180514

0 1
O 1.154314 0.490447 -0.427428
O 0.487888 1.360408 1.555976
O -7.468586 -0.955551 -0.516163
C 3.314447 -0.343372 0.531114
C 4.783255 -0.090875 -0.011121
C 4.313921 -0.127970 -1.515033
C 2.551578 0.842583 -0.156119
C 2.900644 -1.640783 -0.227401
C 3.205936 0.960801 -1.553000
C 3.597213 -1.503090 -1.607561
C 3.137002 -0.397563 2.028331
C 5.398419 1.246611 0.410423
C 5.782068 -1.190932 0.354163
C 0.206093 0.800492 0.517187
C -1.111986 0.351875 0.034702
C -2.216771 0.559408 0.769464
C -3.570010 0.156248 0.383729
C -3.888285 -0.218220 -0.933640
C -4.585703 0.150597 1.367198
C -5.186189 -0.596865 -1.278832
C -5.883837 -0.226729 1.051107
C -6.167314 -0.597556 -0.277127
H 5.105817 0.017459 -2.255451
H 2.559687 1.771049 0.442131
H 1.805247 -1.704345 -0.329111
H 3.224656 -2.541857 0.310699
H 3.615706 1.964498 -1.732450
H 2.467139 0.773142 -2.351102
H 4.313292 -2.317877 -1.788236
H 2.872166 -1.530998 -2.434012
H 3.557072 0.489276 2.519269
H 2.072966 -0.430140 2.304167
H 3.623870 -1.276374 2.464237
H 6.357312 1.410478 -0.094163
H 4.770080 2.112254 0.183820
H 5.587446 1.266078 1.490238
H 5.413317 -2.197076 0.131132
H 6.722789 -1.063944 -0.192161
H 6.012742 -1.168566 1.425402
H -1.108413 -0.148918 -0.934410
H -2.133073 1.064557 1.744844
H -3.113123 -0.209186 -1.702991
H -4.347013 0.442992 2.392093
H -5.424152 -0.882166 -2.298410
H -6.678039 -0.241580 1.795218
H -7.622283 -1.207616 -1.461023


%chk=000180514-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180514

0 1
O 1.145058 0.300660 -0.465049
O 0.377041 1.551793 1.373121
O -7.748880 -0.821453 -0.291142
C 3.372861 -0.503943 0.433785
C 4.848326 -0.054327 0.043680
C 4.509240 0.041375 -1.490723
C 2.556544 0.684815 -0.175441
C 3.152207 -1.736288 -0.505425
C 3.294300 1.018093 -1.508440
C 3.953138 -1.378394 -1.808451
C 3.074965 -0.771754 1.911066
C 5.308215 1.286041 0.672791
C 5.929547 -1.106637 0.387824
C 0.144270 0.796730 0.392161
C -1.173957 0.300768 -0.045597
C -2.308060 0.635048 0.646539
C -3.684728 0.229039 0.354735
C -4.039656 -0.598731 -0.750397
C -4.733046 0.678018 1.212856
C -5.376125 -0.961503 -0.988005
C -6.073723 0.323615 0.988829
C -6.396621 -0.499210 -0.115507
H 5.345481 0.356322 -2.138469
H 2.513846 1.532263 0.530163
H 2.077771 -1.888368 -0.700914
H 3.534569 -2.655275 -0.025456
H 3.603637 2.077102 -1.541250
H 2.632450 0.835500 -2.372541
H 4.767320 -2.100346 -1.998933
H 3.308901 -1.365594 -2.705863
H 3.239998 0.128072 2.532046
H 2.020431 -1.073439 2.051787
H 3.709768 -1.587993 2.304072
H 6.316766 1.550077 0.301770
H 4.642612 2.136558 0.450934
H 5.375980 1.194599 1.773300
H 5.682881 -2.122333 0.037995
H 6.896025 -0.819650 -0.069173
H 6.085486 -1.157652 1.482024
H -1.179322 -0.338521 -0.933815
H -2.164026 1.282481 1.524466
H -3.263392 -0.962207 -1.431854
H -4.483155 1.315929 2.068899
H -5.629187 -1.599629 -1.844824
H -6.876630 0.667428 1.646873
H -7.879823 -1.397976 -1.084746


