%chk=000229145.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229145

0 1
O 3.658348 0.537754 0.003384
O 3.328308 -1.708273 -0.040947
C -5.135795 -0.109640 0.004851
C -6.619287 0.283074 0.014662
C -4.227896 1.127559 0.026926
C -7.526759 -0.954419 -0.007143
C -2.746276 0.731610 0.017087
C -9.010246 -0.562339 0.002650
C -1.833412 1.968364 0.039348
C -9.919008 -1.799548 -0.018784
C -0.385631 1.560962 0.029266
C -11.397013 -1.415409 -0.009213
C 0.292230 1.340013 1.240252
C 0.288314 1.386286 -1.191426
C 1.633371 0.952233 1.243236
C 1.629417 0.998994 -1.213481
C 2.273688 0.798637 0.010476
C 4.101428 -0.784385 -0.023595
C 5.582679 -0.806081 -0.026069
C 6.221175 -2.057550 -0.050440
C 6.338768 0.375286 -0.005003
C 7.615646 -2.121467 -0.053620
C 7.733945 0.302566 -0.008360
C 8.370694 -0.942928 -0.032608
H -4.914808 -0.723166 -0.890015
H -4.912004 -0.756724 0.875041
H -6.840903 0.895851 0.909636
H -6.843775 0.929062 -0.855909
H -4.449617 1.740180 0.922063
H -4.452374 1.773700 -0.843620
H -7.302564 -1.600784 0.863293
H -7.305451 -1.567556 -0.902016
H -2.518521 0.084370 0.886761
H -2.521227 0.118115 -0.877398
H -9.236234 0.083447 -0.867469
H -9.233262 0.050692 0.896893
H -2.056593 2.587288 0.932079
H -2.059351 2.621016 -0.828318
H -9.695389 -2.445740 0.852559
H -9.698312 -2.412990 -0.914210
H -11.658324 -0.838663 0.885249
H -12.037230 -2.304451 -0.024892
H -11.661146 -0.805500 -0.880551
H -0.232211 1.466086 2.186779
H -0.239168 1.548242 -2.130777
H 2.171795 0.773838 2.170911
H 2.164824 0.856038 -2.149006
H 5.620124 -2.970926 -0.066732
H 5.830335 1.343509 0.013894
H 8.115074 -3.089282 -0.072472
H 8.324914 1.217330 0.007940
H 9.459707 -0.996280 -0.035161


%chk=000229145-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229145

0 1
O 3.751452 0.666175 0.005892
O 3.309154 -1.638348 -0.045770
C -5.160125 -0.050268 0.019375
C -6.671433 0.273438 0.013070
C -4.260602 1.206236 0.033250
C -7.562909 -0.988887 0.001412
C -2.753902 0.866173 0.031759
C -9.076167 -0.674879 -0.008538
C -1.844329 2.127141 0.048071
C -9.962210 -1.941632 -0.019173
C -0.365865 1.770368 0.037971
C -11.473088 -1.623015 -0.028953
C 0.339495 1.552638 1.250156
C 0.330699 1.591055 -1.185559
C 1.695529 1.160251 1.248647
C 1.686666 1.199285 -1.206590
C 2.351194 0.985174 0.015577
C 4.134326 -0.700778 -0.025661
C 5.619054 -0.839966 -0.031193
C 6.161534 -2.151604 -0.065727
C 6.484263 0.284921 -0.003495
C 7.558774 -2.336708 -0.072775
C 7.882038 0.093753 -0.010538
C 8.421395 -1.214430 -0.045213
H -4.914294 -0.665460 -0.871335
H -4.923953 -0.678181 0.903759
H -6.919169 0.889075 0.903164
H -6.909536 0.898560 -0.873020
H -4.499671 1.819958 0.927207
H -4.496995 1.837386 -0.849222
H -7.324564 -1.612604 0.888464
H -7.311654 -1.605390 -0.887158
H -2.512028 0.235447 0.910971
H -2.509656 0.256883 -0.861808
H -9.317346 -0.053190 -0.896308
H -9.330234 -0.058997 0.879705
H -2.087272 2.726868 0.947302
H -2.092515 2.753037 -0.831676
H -9.719439 -2.562124 0.867701
H -9.706957 -2.556051 -0.906819
H -11.760500 -1.037118 0.864630
H -12.082663 -2.545443 -0.038322
H -11.746796 -1.028083 -0.920886
H -0.177992 1.692257 2.206956
H -0.193971 1.760809 -2.133541
H 2.240808 0.992954 2.182850
H 2.224996 1.062055 -2.149672
H 5.473411 -3.003301 -0.086595
H 6.053461 1.289360 0.023082
H 7.975949 -3.349032 -0.099637
H 8.550940 0.960879 0.010882
H 9.507692 -1.358647 -0.050667


