%chk=000191837.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191837

0 1
O 0.339474 -2.405499 0.578281
O -5.384022 0.441042 0.358070
O -5.640472 -2.219111 0.367945
O 6.243622 -0.442673 -0.979823
C -1.028439 1.245019 -0.493416
C -1.985429 0.069794 -0.111550
C 0.296026 1.138378 0.275066
C 0.995167 -0.189211 -0.143493
C -3.294409 0.493761 -0.851277
C -1.901499 2.495604 -0.308093
C -1.335851 -1.228326 -0.616851
C -3.316869 2.041785 -0.732759
C 2.358809 -0.370398 0.596154
C 1.208269 2.340584 -0.012310
C 0.041088 -1.377034 0.016265
C -2.245658 -0.043501 1.395240
C 2.550335 2.192584 0.712920
C 3.198906 0.885574 0.351790
C -4.535842 -0.149791 -0.271303
C 2.177933 -0.561559 2.111950
C 3.044638 -1.622873 0.072806
C 4.438325 0.843350 -0.157447
C -4.712913 -1.641545 -0.546109
C 4.276856 -1.645048 -0.437987
C 5.103513 -0.416150 -0.563068
H -0.793402 1.168834 -1.586562
H 0.092078 1.103360 1.374839
H 1.233875 -0.125860 -1.239411
H -3.222128 0.211031 -1.927835
H -1.545873 3.340381 -0.918783
H -1.895351 2.843737 0.739176
H -1.244594 -1.242348 -1.718606
H -1.959370 -2.113422 -0.361004
H -4.073712 2.363364 0.010225
H -3.614584 2.498057 -1.690232
H 0.711480 3.276907 0.307582
H 1.380459 2.447701 -1.101383
H -2.843219 -0.929550 1.646154
H -1.316427 -0.121814 1.973040
H -2.790133 0.828606 1.780921
H 2.408584 2.246682 1.813327
H 3.207897 3.051107 0.463888
H 1.607735 -1.479465 2.325665
H 3.146928 -0.658811 2.617464
H 1.642878 0.273395 2.574261
H 2.454262 -2.542117 0.180689
H 5.040644 1.739236 -0.315337
H -3.780158 -2.224929 -0.390251
H -5.080982 -1.814289 -1.576956
H 4.756603 -2.561262 -0.785871
H -6.322748 -1.544585 0.630399


%chk=000191837-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191837

0 1
O 0.347292 -2.380100 1.052406
O -5.313240 0.074842 0.567751
O -6.087354 -2.212502 -0.605385
O 6.143671 -0.536908 -1.496771
C -1.056502 1.210867 -0.325109
C -2.004276 0.035539 0.080181
C 0.314689 1.160007 0.381452
C 1.013836 -0.213818 0.047384
C -3.284027 0.441307 -0.761769
C -1.937585 2.473672 -0.165686
C -1.326749 -1.297825 -0.337340
C -3.371925 1.993995 -0.574991
C 2.464657 -0.347819 0.677288
C 1.217286 2.339814 -0.046182
C 0.055295 -1.393299 0.326142
C -2.322839 0.002482 1.596969
C 2.636957 2.235292 0.569387
C 3.255755 0.891714 0.241272
C -4.550881 -0.295840 -0.372042
C 2.411096 -0.405914 2.245816
C 3.114581 -1.641649 0.208555
C 4.433575 0.801914 -0.450091
C -4.922982 -1.558270 -1.153099
C 4.289856 -1.704134 -0.479556
C 5.040890 -0.484172 -0.856277
H -0.859019 1.087813 -1.415962
H 0.159503 1.226712 1.477352
H 1.151747 -0.210200 -1.059200
H -3.054654 0.197281 -1.819909
H -1.586077 3.306632 -0.798531
H -1.923898 2.831536 0.880706
H -1.199033 -1.320223 -1.439788
H -1.906914 -2.185494 -0.029584
H -4.116436 2.228530 0.204743
H -3.712880 2.473558 -1.509125
H 0.749310 3.294009 0.260858
H 1.299758 2.355597 -1.152415
H -2.984742 -0.847888 1.837684
H -1.406491 -0.123257 2.200351
H -2.836019 0.918539 1.932992
H 2.557848 2.367715 1.667560
H 3.277274 3.051911 0.191191
H 1.891043 -1.320378 2.572102
H 3.437673 -0.417472 2.651141
H 1.885662 0.466643 2.671364
H 2.592390 -2.559373 0.502128
H 4.981566 1.705218 -0.746877
H -4.062845 -2.260198 -1.154392
H -5.105314 -1.262889 -2.210744
H 4.733744 -2.662903 -0.772069
H -6.431969 -1.621906 0.124523


