%chk=000236136.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236136

0 1
O 3.573592 0.144950 -0.105199
O 0.181533 0.209206 0.303228
O -3.067531 0.682848 0.677458
O -3.510417 -1.066360 -0.691957
O -7.155340 0.658624 -0.904677
C 5.813887 -0.399558 0.278860
C 4.550224 -0.875513 -0.437515
C 6.981985 -1.363703 0.045049
C 2.273508 -0.084341 -0.696191
C 1.384400 0.954889 -0.010713
C 8.246556 -0.892961 0.759243
C -0.742250 0.926251 1.154700
C -1.931040 -0.021860 1.270341
C -4.813976 1.006048 -0.817152
C -3.765847 0.057333 -0.330193
C -6.080822 0.327328 -1.342045
C -5.892628 -0.692807 -2.412194
H 6.072139 0.621328 -0.067102
H 5.604873 -0.291874 1.362206
H 4.192044 -1.849860 -0.063852
H 4.672792 -0.914379 -1.532860
H 7.181484 -1.460760 -1.040546
H 6.711203 -2.378801 0.397452
H 1.922083 -1.110812 -0.474943
H 2.345730 0.062571 -1.785919
H 1.859774 1.328928 0.916316
H 1.117693 1.797616 -0.667977
H 8.564823 0.095686 0.408422
H 8.095887 -0.821434 1.842794
H 9.078888 -1.585194 0.588895
H -1.028565 1.883310 0.679695
H -0.258768 1.118704 2.128476
H -1.743854 -0.980487 0.737912
H -2.245605 -0.211623 2.309683
H -4.383912 1.651516 -1.615996
H -5.093792 1.722452 -0.004238
H -6.837789 -1.198631 -2.659968
H -5.168484 -1.475228 -2.108595
H -5.499079 -0.255300 -3.338996


%chk=000236136-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236136

0 1
O 3.381224 0.035603 0.600993
O -0.225796 0.282648 1.223983
O -2.950526 1.113119 0.362703
O -3.556701 -1.091731 -0.131569
O -5.984080 1.336339 -2.410794
C 5.705428 -0.384983 0.041801
C 4.264423 -0.863187 -0.154975
C 6.726461 -1.261523 -0.720332
C 1.970633 -0.343318 0.487922
C 1.186407 0.673456 1.315149
C 8.181159 -0.786018 -0.517205
C -1.103946 1.181245 1.969542
C -2.538103 0.727641 1.742889
C -3.707059 0.672207 -1.863182
C -3.406411 0.101346 -0.481041
C -5.162981 0.390756 -2.309859
C -5.512423 -1.051350 -2.624470
H 5.781885 0.666109 -0.297970
H 5.937975 -0.388860 1.124323
H 4.142219 -1.908171 0.211806
H 3.986678 -0.845517 -1.233887
H 6.483448 -1.255520 -1.802627
H 6.632443 -2.314759 -0.384981
H 1.800908 -1.368340 0.882032
H 1.635010 -0.316076 -0.571142
H 1.533578 0.654655 2.370271
H 1.338982 1.696900 0.911643
H 8.311202 0.253689 -0.871858
H 8.460272 -0.812126 0.552876
H 8.895293 -1.423996 -1.069290
H -0.973084 2.231885 1.630513
H -0.878001 1.135550 3.059601
H -2.635774 -0.365560 1.858170
H -3.228241 1.251205 2.426619
H -3.018839 0.178129 -2.575689
H -3.528802 1.756920 -1.866571
H -6.596029 -1.158702 -2.783351
H -5.164923 -1.711251 -1.808872
H -4.978509 -1.370314 -3.541272


