%chk=000179543.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179543

0 1
O 3.216795 -1.822283 0.052642
O 5.218815 0.454506 -0.025832
O 0.650855 -1.176776 0.013978
O 1.761810 3.500713 0.144527
O -0.632953 2.787090 0.114274
C 1.056341 1.178249 0.106005
C 1.535888 -0.145658 0.070162
C 2.911414 -0.462589 0.085491
C 2.067334 2.203026 0.114946
C 3.870173 0.578096 0.049359
C 3.439035 1.910006 0.079228
C -0.347129 1.577297 0.119794
C -1.435946 0.580841 0.150022
C -3.827587 -0.011151 -0.169774
C -2.691731 0.923034 -0.177683
C -3.674992 -1.347288 -0.575376
C -5.091601 0.449053 0.241119
C 3.379905 -2.395656 1.385199
C -4.772883 -2.211857 -0.565905
C -6.182288 -0.422315 0.256559
C 5.798037 -0.866565 -0.214196
C -6.025569 -1.752806 -0.147927
H 4.162954 2.724624 0.061674
H -1.171816 -0.433785 0.463116
H -2.929573 1.957332 -0.468239
H -2.700975 -1.706773 -0.906258
H -5.218725 1.484569 0.555276
H 1.145618 -2.058283 -0.099218
H 0.708878 3.680377 0.143104
H 2.472632 -2.255387 1.977436
H 4.239480 -1.939796 1.885043
H 3.560467 -3.452199 1.162999
H -4.650969 -3.245759 -0.885178
H -7.158033 -0.064319 0.582088
H 5.234175 -1.443014 -0.957388
H 5.821333 -1.381024 0.750624
H 6.806310 -0.619975 -0.568569
H -6.878979 -2.428655 -0.138620


%chk=000179543-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179543

0 1
O 3.290015 -1.966607 0.330020
O 5.267380 0.238891 0.367802
O 0.709315 -1.427911 0.185375
O 1.669345 3.404056 0.261027
O -0.669628 2.693970 0.119918
C 1.049096 1.027378 0.193289
C 1.553942 -0.312476 0.215106
C 2.938192 -0.582840 0.288421
C 2.047190 2.090085 0.262342
C 3.883752 0.479397 0.295708
C 3.433838 1.807431 0.304918
C -0.371172 1.416237 0.115761
C -1.459693 0.430552 0.031703
C -3.954840 -0.011806 -0.131067
C -2.767381 0.843467 -0.040049
C -3.889991 -1.437439 -0.162453
C -5.238472 0.606346 -0.192333
C 3.910604 -2.387304 1.617571
C -5.064206 -2.207909 -0.251758
C -6.414805 -0.165731 -0.281545
C 5.835044 -0.570263 -0.739462
C -6.332513 -1.577273 -0.311783
H 4.148697 2.632047 0.325542
H -1.175928 -0.622539 0.030189
H -2.940016 1.929504 -0.027983
H -2.917492 -1.939255 -0.117119
H -5.302464 1.701095 -0.169214
H 1.312414 -2.228242 0.171614
H 0.607806 3.400809 0.204350
H 3.216200 -2.200594 2.457543
H 4.851307 -1.833980 1.780534
H 4.108189 -3.464842 1.512558
H -4.998172 -3.301342 -0.275398
H -7.391265 0.328494 -0.327830
H 5.757917 -0.007233 -1.687837
H 5.315636 -1.540077 -0.834221
H 6.892665 -0.718015 -0.475283
H -7.244006 -2.181182 -0.381452


