%chk=000239239.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239239

0 1
C 0.582632 -0.418341 0.658879
C -0.588252 0.239436 -0.083507
C -1.946961 -0.254573 0.428318
C 1.922007 0.217157 0.320291
C -3.103604 0.428077 -0.314526
C 0.806611 -1.871821 0.245044
C 2.791392 -0.789032 -0.201916
C -4.464645 -0.064108 0.195213
C 2.054482 -2.064753 -0.229673
C 2.357107 1.522754 0.463423
C -5.622719 0.617801 -0.547046
C 4.089617 -0.477708 -0.579041
C 3.674698 1.833443 0.077444
C 4.524445 0.851753 -0.434070
C -6.980150 0.132019 -0.043672
H 0.414628 -0.367836 1.762418
H -0.494943 0.044935 -1.170611
H -0.520350 1.339686 0.028531
H -2.019775 -1.352698 0.307137
H -2.034275 -0.064473 1.515513
H -3.017415 0.236818 -1.401776
H -3.032154 1.526471 -0.195697
H 0.018366 -2.594382 0.348721
H -4.552973 0.126043 1.282100
H -4.538630 -1.162133 0.075944
H 2.495320 -2.978669 -0.586017
H -5.551464 1.716630 -0.427432
H -5.537349 0.426176 -1.634661
H 1.705750 2.295116 0.862897
H 4.757172 -1.237126 -0.976371
H 4.031760 2.856332 0.181943
H 5.539704 1.114426 -0.725867
H -7.800014 0.623991 -0.578862
H -7.113404 0.340936 1.023850
H -7.099414 -0.948447 -0.183020


%chk=000239239-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239239

0 1
C 0.623395 -0.397982 0.671954
C -0.583937 0.275158 -0.047628
C -1.957290 -0.277080 0.394364
C 1.976119 0.214967 0.317508
C -3.139804 0.446379 -0.288901
C 0.833684 -1.868862 0.316318
C 2.843438 -0.808518 -0.176936
C -4.521273 -0.080524 0.160719
C 2.100757 -2.082765 -0.163446
C 2.423289 1.543073 0.412880
C -5.703159 0.640962 -0.526468
C 4.164509 -0.503539 -0.575115
C 3.750015 1.851468 0.012164
C 4.610570 0.836793 -0.475723
C -7.080075 0.113138 -0.068622
H 0.446231 -0.307413 1.767480
H -0.460436 0.153418 -1.141588
H -0.550163 1.364837 0.156183
H -2.017704 -1.361004 0.168897
H -2.055412 -0.180148 1.496424
H -3.047354 0.340043 -1.390008
H -3.076473 1.534258 -0.075910
H 0.059014 -2.629328 0.444874
H -4.616243 0.029828 1.261536
H -4.586451 -1.168984 -0.048725
H 2.513522 -3.041478 -0.489612
H -5.634967 1.728679 -0.319737
H -5.608922 0.527596 -1.625875
H 1.766159 2.335353 0.791365
H 4.833971 -1.284884 -0.952888
H 4.113918 2.882939 0.080955
H 5.631644 1.095312 -0.779191
H -7.907384 0.644719 -0.573898
H -7.211073 0.243016 1.022433
H -7.184914 -0.965527 -0.291881


