%chk=000185341.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185341

0 1
O -1.568756 -0.474697 0.312419
O -1.640799 3.639311 0.228498
O 3.031663 -0.819199 0.081031
O 0.983096 3.570989 0.117843
C -2.801383 0.281968 0.619684
C -2.833091 1.610745 -0.118105
C -0.349783 1.637584 0.182749
C -1.574730 2.435970 0.128975
C -0.401726 0.219189 0.228714
C -3.920658 -0.638778 0.198032
C 0.939793 2.214865 0.141791
C 0.740235 -0.582407 0.185634
C 1.993472 0.054451 0.120485
C -5.143242 -0.582557 0.883693
C -3.754611 -1.530325 -0.869567
C 2.118699 1.454748 0.108093
C -6.196205 -1.413569 0.493289
C -4.810064 -2.363813 -1.251215
C -6.031248 -2.304562 -0.573112
C 4.404777 -0.289641 0.024579
C 5.242059 -1.522024 -0.004724
C 6.582481 -1.520047 -0.058265
C 7.364495 -2.794627 -0.084962
C 7.385912 -0.257119 -0.094709
H -2.765826 0.422661 1.725969
H -3.731406 2.195564 0.170912
H -2.937690 1.458405 -1.214590
H 0.667801 -1.666351 0.213123
H -5.276747 0.105119 1.717086
H -2.795113 -1.577861 -1.388242
H 3.082170 1.938601 0.073404
H -7.146845 -1.368758 1.022505
H -4.678433 -3.059909 -2.078309
H -6.853299 -2.952344 -0.872864
H 4.498492 0.318245 -0.893471
H 4.571202 0.324144 0.928326
H 1.911352 3.925377 0.078583
H 4.662090 -2.449078 0.021875
H 7.976218 -2.865913 -0.995572
H 8.046959 -2.859488 0.774448
H 6.726434 -3.688341 -0.056141
H 7.133390 0.353038 -0.973258
H 7.205360 0.358172 0.797926
H 8.467107 -0.442637 -0.138065


%chk=000185341-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185341

0 1
O -1.507055 -0.515434 -0.055929
O -1.728308 3.674568 -0.228967
O 3.205481 -0.705406 -0.403430
O 1.012748 3.690864 -0.249596
C -2.706309 0.221792 0.441315
C -2.854420 1.524745 -0.363862
C -0.324784 1.673042 -0.179863
C -1.606523 2.415065 -0.237119
C -0.328255 0.232264 -0.154661
C -3.900148 -0.704189 0.319220
C 0.961683 2.296922 -0.247320
C 0.847067 -0.529598 -0.237777
C 2.092190 0.130875 -0.332903
C -4.936390 -0.638436 1.282430
C -4.025802 -1.593758 -0.776315
C 2.157495 1.547772 -0.327282
C -6.092072 -1.439738 1.147319
C -5.176502 -2.402140 -0.906073
C -6.215343 -2.324420 0.051273
C 4.552264 -0.070519 -0.531689
C 5.549646 -1.174796 -0.720971
C 6.596487 -1.484330 0.098075
C 7.533713 -2.627246 -0.254251
C 6.939926 -0.763574 1.389414
H -2.519152 0.468468 1.507877
H -3.731134 2.099823 -0.021032
H -3.015340 1.274252 -1.431648
H 0.800959 -1.619746 -0.208613
H -4.840110 0.039097 2.140317
H -3.211238 -1.663489 -1.504307
H 3.117295 2.072699 -0.375365
H -6.888319 -1.380434 1.897669
H -5.263162 -3.093958 -1.751524
H -7.108019 -2.951446 -0.052136
H 4.529566 0.597958 -1.417915
H 4.753831 0.537373 0.370155
H 1.950971 3.999255 -0.341962
H 5.392867 -1.778715 -1.624845
H 8.580366 -2.272982 -0.334941
H 7.521348 -3.399742 0.539582
H 7.257763 -3.108382 -1.207644
H 7.924970 -0.263284 1.306301
H 6.198187 -0.004093 1.684565
H 7.025165 -1.491882 2.218924


