%chk=000216283.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216283

0 1
O 1.503680 -1.119572 -1.007816
O 3.224968 -0.716573 0.373688
O -0.844933 -2.429705 0.306181
O 2.995866 0.719822 -2.915546
O 2.859935 3.117833 -1.062233
O 4.853276 2.516475 1.078309
O 4.157965 0.907340 3.203853
O -4.054199 0.647249 2.012450
O -5.533713 2.020254 2.877400
C 1.286462 -2.563825 -0.917044
C -0.261521 -2.675109 -1.042948
C 2.825362 -0.614397 -1.012861
C 2.641587 0.834074 -1.526756
C 3.572196 1.883889 -0.887086
C 3.838812 1.622784 0.604877
C 4.263459 0.160143 0.839494
C -0.921222 -1.667187 -2.013980
C 1.946930 -3.253927 -2.110413
C 1.775984 -3.088008 0.420635
C -1.860780 -0.895991 -1.139231
C -1.733725 -1.393555 0.206541
C 4.363741 -0.203445 2.339336
C -2.725817 0.128828 -1.411017
C -2.454467 -0.895459 1.271108
C -3.498200 0.682905 -0.347108
C -3.343075 0.160512 0.960330
C -4.431268 1.759420 -0.542284
C -5.143500 2.253596 0.498232
C -5.004626 1.731582 1.840770
H -0.555868 -3.726292 -1.243378
H 3.525901 -1.217155 -1.622167
H 1.572867 1.154046 -1.429651
H 4.522433 1.964592 -1.466940
H 2.956057 1.892719 1.243284
H 5.200643 -0.082285 0.294112
H -1.443670 -2.180250 -2.840025
H -0.164311 -0.995857 -2.475063
H 3.040011 -3.268900 -2.016356
H 1.631424 -4.298762 -2.207367
H 1.712180 -2.741292 -3.052269
H 1.259286 -2.566530 1.246621
H 2.847395 -2.893301 0.568507
H 1.597667 -4.159857 0.542494
H 5.336298 -0.670920 2.571027
H 3.535693 -0.895242 2.618298
H -2.838781 0.529171 -2.417456
H 2.707671 1.529985 -3.396218
H 3.202987 3.802583 -0.440930
H 5.693341 2.403835 0.584639
H -2.358811 -1.266422 2.288249
H 4.767425 1.654698 2.976011
H -4.548468 2.165812 -1.550633
H -5.859245 3.069472 0.389228


%chk=000216283-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216283

0 1
O 1.376295 -0.999367 -0.250662
O 3.524056 -0.659874 0.664166
O -1.132538 -2.316343 0.429938
O 1.634588 1.331740 -1.884210
O 3.288039 3.338023 -0.625940
O 5.825158 2.335485 0.523451
O 5.804598 0.564234 2.821727
O -4.939987 0.476693 1.538932
O -6.759935 1.788626 2.092440
C 1.177771 -2.463043 -0.511377
C -0.337062 -2.561154 -0.833262
C 2.621909 -0.382365 -0.497709
C 2.354153 1.128569 -0.623869
C 3.671173 1.923573 -0.638178
C 4.563420 1.549593 0.548716
C 4.826908 0.028918 0.549444
C -0.860308 -1.536938 -1.891558
C 1.978486 -2.959816 -1.735604
C 1.543287 -3.246300 0.763478
C -2.038274 -0.880628 -1.192071
C -2.104923 -1.362160 0.146642
C 5.720938 -0.414209 1.739041
C -2.956152 0.074421 -1.622973
C -3.059348 -0.925057 1.075577
C -3.956421 0.553550 -0.719316
C -3.982704 0.039597 0.618495
C -4.949177 1.536188 -1.078241
C -5.897085 1.974656 -0.175200
C -5.956917 1.474066 1.193057
H -0.563460 -3.606595 -1.115458
H 3.123289 -0.754009 -1.420163
H 1.748130 1.455142 0.244905
H 4.213244 1.690479 -1.586997
H 4.090557 1.838774 1.499974
H 5.307921 -0.262744 -0.418156
H -1.153188 -2.041770 -2.828804
H -0.082329 -0.783892 -2.115159
H 3.062597 -2.958441 -1.527218
H 1.692819 -4.003110 -1.959628
H 1.785326 -2.347785 -2.634586
H 0.966279 -2.860133 1.617104
H 2.617649 -3.125613 0.979079
H 1.315016 -4.321722 0.640791
H 6.734832 -0.669782 1.366451
H 5.270162 -1.313015 2.189333
H -2.924307 0.471022 -2.644239
H 1.485429 2.307553 -1.981952
H 4.092253 3.877730 -0.411166
H 6.354481 2.077369 -0.276304
H -3.100483 -1.298033 2.100497
H 6.217403 1.392172 2.455461
H -4.942591 1.940363 -2.097819
H -6.651675 2.719162 -0.439982


