%chk=000185518.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185518

0 1
O -2.223549 1.904119 0.117294
O -2.931481 -0.337522 -0.206040
O 0.746040 2.589534 0.562821
O 1.732613 -1.961203 0.259222
O -1.006881 -2.694292 -0.243131
C 1.150285 0.272990 0.376891
C -1.126092 1.032482 0.162736
C 0.214254 1.343206 0.363801
C -1.553994 -0.301535 -0.032901
C 0.707790 -1.054136 0.204008
C -0.671801 -1.373451 -0.005410
C 2.609123 0.568193 0.578982
C -3.386713 1.056482 -0.124305
C 3.296909 0.927648 -0.708555
C -0.202487 3.692660 0.571158
C 1.427429 -3.370843 0.092620
C -2.311906 -3.093027 0.257519
C 4.598689 0.741209 -0.917411
H 2.722451 1.417154 1.294121
H 3.105855 -0.303606 1.062549
H -4.053895 1.137890 0.743255
H -3.807526 1.324107 -1.102423
H 2.649144 1.374944 -1.465106
H 0.453883 4.552908 0.741462
H -0.923460 3.560977 1.384701
H -0.713177 3.754354 -0.395814
H 0.785661 -3.714706 0.908769
H 2.427796 -3.816315 0.139506
H 0.952346 -3.541803 -0.880663
H -2.364612 -2.943475 1.338329
H -2.339508 -4.155048 -0.008266
H -3.100199 -2.532528 -0.260369
H 5.093673 1.016563 -1.836046
H 5.268039 0.298668 -0.196003


%chk=000185518-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185518

0 1
O -2.316412 1.901821 -0.002149
O -3.029720 -0.362144 -0.171307
O 0.708342 2.631399 0.498202
O 1.562159 -2.108529 0.675961
O -1.123163 -2.754179 0.102221
C 1.082072 0.259984 0.533435
C -1.185890 1.022665 0.140627
C 0.158032 1.344846 0.394500
C -1.617004 -0.315470 0.044985
C 0.626189 -1.080673 0.443386
C -0.751144 -1.404218 0.211006
C 2.559242 0.559472 0.763042
C -3.369089 1.027834 -0.560873
C 3.272818 0.914275 -0.534130
C -0.206135 3.779606 0.633314
C 1.815938 -3.018690 -0.463858
C -2.337003 -3.156150 0.846114
C 4.347001 0.250917 -1.030567
H 2.639668 1.417977 1.456861
H 3.037683 -0.318367 1.226561
H -4.336241 1.300188 -0.115475
H -3.356940 1.101172 -1.667394
H 2.860444 1.776582 -1.078242
H 0.454705 4.644994 0.792111
H -0.879259 3.647985 1.499276
H -0.809437 3.918680 -0.279575
H 0.888849 -3.539963 -0.756635
H 2.561232 -3.740304 -0.095091
H 2.230421 -2.450760 -1.318745
H -2.206565 -2.959501 1.926774
H -2.434954 -4.237705 0.668747
H -3.227011 -2.622870 0.470085
H 4.828000 0.554510 -1.967836
H 4.777871 -0.612785 -0.508030


