%chk=000185405.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185405

0 1
O -1.539252 2.886543 -0.669044
O 1.777570 -0.191432 0.492253
O -4.196608 -1.029643 -0.837145
O -0.908126 4.500794 0.747696
O 2.040047 -0.963223 -1.621586
C -1.969136 -0.376362 -0.296449
C -0.514913 -0.912151 -0.107250
C -1.985406 0.649814 -1.449973
C 0.393801 0.251804 0.315019
C 0.403620 1.446841 -0.658367
C -0.935905 1.740704 -1.382198
C -2.866362 -1.577742 -0.741363
C -0.490563 -2.084232 0.853911
C -2.836526 -2.741411 0.256149
C -2.518297 0.254811 0.985158
C -1.397192 -3.224244 0.452249
C 0.674463 2.721728 0.104246
C -0.602009 3.506385 0.148198
C 0.266302 -2.164857 1.949198
C 1.815555 3.112538 0.660942
C 2.477964 -0.833288 -0.503453
C 3.807433 -1.289131 0.087247
C 3.721189 -2.798116 0.317197
C 4.933952 -0.904893 -0.868532
H -0.145071 -1.291881 -1.101670
H -2.997858 1.125959 -1.472714
H -1.893586 0.128730 -2.424933
H 0.175532 0.577300 1.362884
H 1.191849 1.261024 -1.432726
H -0.736139 2.149796 -2.401035
H -2.580472 -1.927500 -1.759445
H -3.476061 -3.571683 -0.093932
H -3.268081 -2.415273 1.224757
H -3.616632 0.330459 0.933030
H -2.270826 -0.329964 1.876175
H -2.147800 1.277565 1.128318
H -1.012705 -3.687658 -0.480307
H -1.377500 -4.032960 1.210488
H -4.848691 -1.733472 -1.006254
H 0.951540 -1.394349 2.273646
H 0.262920 -3.015426 2.612750
H 2.722928 2.520476 0.626488
H 1.916458 4.050640 1.199157
H 3.960342 -0.775870 1.073518
H 4.644111 -3.179161 0.770634
H 3.569366 -3.346452 -0.622098
H 2.892109 -3.056256 0.990659
H 5.898794 -1.288093 -0.514652
H 5.029463 0.182122 -0.972499
H 4.769004 -1.316712 -1.874942


%chk=000185405-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185405

0 1
O -1.478084 2.866490 -0.185536
O 1.748967 -0.168893 0.610144
O -4.280647 -1.089086 -1.022191
O -0.369068 4.495730 1.067107
O 2.076820 -1.076915 -1.524401
C -2.077113 -0.385743 -0.246171
C -0.593677 -0.920756 -0.064045
C -2.089447 0.717286 -1.341209
C 0.332225 0.252049 0.323721
C 0.372198 1.401100 -0.728379
C -1.047426 1.823496 -1.196236
C -2.912058 -1.588040 -0.789952
C -0.582421 -2.110702 0.897791
C -2.899766 -2.809450 0.146360
C -2.687678 0.146312 1.077714
C -1.441198 -3.271505 0.411650
C 0.882179 2.688133 -0.102086
C -0.314811 3.483495 0.346259
C 0.067014 -2.162357 2.090485
C 2.151200 3.125008 0.079974
C 2.492356 -0.837927 -0.363932
C 3.860528 -1.238840 0.180220
C 3.895889 -2.782723 0.350761
C 4.974719 -0.755451 -0.780213
H -0.269375 -1.289238 -1.060597
H -3.095941 1.166712 -1.399485
H -1.902754 0.241653 -2.326622
H 0.027116 0.650714 1.307225
H 0.971169 1.062042 -1.588557
H -0.962038 2.372514 -2.153905
H -2.465623 -1.894212 -1.766423
H -3.476516 -3.638284 -0.313141
H -3.398204 -2.549634 1.098247
H -3.781303 0.231345 0.960681
H -2.474757 -0.525722 1.927277
H -2.305542 1.150486 1.323428
H -1.016484 -3.669857 -0.534523
H -1.431097 -4.096342 1.146071
H -4.857275 -1.846818 -1.293009
H 0.695325 -1.347011 2.460481
H -0.011751 -3.050506 2.729639
H 3.019159 2.544679 -0.249488
H 2.331935 4.087381 0.572885
H 3.981730 -0.763808 1.169762
H 4.870623 -3.089233 0.770567
H 3.763620 -3.279847 -0.626704
H 3.098437 -3.131148 1.031058
H 5.961188 -1.088624 -0.411557
H 4.994845 0.347014 -0.861353
H 4.817407 -1.172367 -1.790394


