%chk=000238792.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238792

0 1
O -5.046280 0.243947 -0.346450
C 1.269759 0.406933 -0.876761
C 1.693731 -0.083731 0.541216
C 3.002866 -0.931778 0.598749
C -0.178653 1.013083 -0.776697
C 1.267164 -0.782024 -1.869955
C 1.719088 1.103603 1.521931
C 2.931409 -2.060137 -0.465055
C 2.597278 -1.540009 -1.864965
C 2.181302 1.514883 -1.437204
C 0.348810 1.790997 1.607163
C -0.192140 2.135845 0.244174
C -1.258492 -0.031487 -0.419228
C 3.090147 -1.610337 1.988218
C 4.279943 -0.100072 0.398060
C -2.670914 0.538151 -0.559850
C -0.670827 3.348689 -0.044592
C -3.786941 -0.477088 -0.232442
C -3.826579 -1.664596 -1.195279
C -3.796883 -0.879953 1.226710
C -3.044689 -1.836384 1.761761
H 0.878264 -0.777624 0.880607
H -0.428453 1.428571 -1.784763
H 1.045850 -0.417900 -2.889906
H 0.443771 -1.481433 -1.617630
H 2.485140 1.839619 1.210204
H 2.021443 0.757993 2.529075
H 2.170955 -2.804217 -0.160252
H 3.891354 -2.607887 -0.488831
H 2.548109 -2.386178 -2.576560
H 3.410858 -0.884940 -2.232225
H 2.161503 2.413638 -0.809851
H 3.227367 1.177875 -1.490387
H 1.879531 1.815076 -2.444534
H 0.426991 2.694098 2.243758
H -0.379322 1.129147 2.122132
H -1.098730 -0.397458 0.615564
H -1.141123 -0.919399 -1.075257
H 2.217908 -2.237802 2.192097
H 3.977582 -2.245822 2.064390
H 3.152842 -0.867590 2.790857
H 4.262418 0.428817 -0.567031
H 4.400171 0.654116 1.181299
H 5.174017 -0.730532 0.410858
H -2.822262 0.930855 -1.582786
H -2.792013 1.419105 0.107278
H -1.074228 3.619698 -1.006193
H -0.696102 4.164588 0.658963
H -3.810145 -1.347828 -2.242220
H -4.740247 -2.253561 -1.038629
H -2.975747 -2.337454 -1.042495
H -4.507827 -0.293771 1.820033
H -5.238392 0.479833 -1.269021
H -3.079591 -2.089455 2.812346
H -2.344395 -2.441715 1.205309


%chk=000238792-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238792

0 1
O -5.145857 0.303370 -0.174170
C 1.299715 0.400273 -0.913048
C 1.756516 -0.043794 0.532673
C 3.090958 -0.888430 0.629690
C -0.179388 0.989616 -0.820057
C 1.340464 -0.831359 -1.863904
C 1.707394 1.147610 1.523793
C 3.058504 -2.024302 -0.441915
C 2.713284 -1.539931 -1.865994
C 2.170604 1.532439 -1.532423
C 0.294897 1.793460 1.575624
C -0.206618 2.144095 0.183803
C -1.289699 -0.064105 -0.500776
C 3.147009 -1.579523 2.024842
C 4.396529 -0.057272 0.479420
C -2.709149 0.543603 -0.479871
C -0.631117 3.392086 -0.144002
C -3.860002 -0.463093 -0.162064
C -3.949727 -1.604585 -1.192879
C -3.763726 -0.932805 1.281413
C -3.359960 -2.148161 1.722944
H 0.972068 -0.760255 0.867964
H -0.416751 1.401297 -1.825573
H 1.060254 -0.513762 -2.889499
H 0.589573 -1.579787 -1.542615
H 2.446918 1.918794 1.236888
H 1.978648 0.808180 2.540894
H 2.297143 -2.773417 -0.135332
H 4.036324 -2.547482 -0.437404
H 2.682758 -2.406954 -2.554883
H 3.503546 -0.867227 -2.250259
H 2.192009 2.434793 -0.898877
H 3.210626 1.220136 -1.713839
H 1.741060 1.832025 -2.508222
H 0.305615 2.692941 2.219038
H -0.400838 1.067119 2.047577
H -1.098499 -0.559614 0.469506
H -1.253391 -0.852387 -1.274201
H 2.205121 -2.118114 2.244078
H 3.971435 -2.317747 2.049412
H 3.327706 -0.857807 2.841923
H 4.542127 0.338067 -0.539106
H 4.418159 0.797953 1.178971
H 5.269123 -0.697353 0.712571
H -2.919619 1.001029 -1.473070
H -2.763934 1.365261 0.258167
H -0.977991 3.635636 -1.156018
H -0.640545 4.208239 0.589146
H -4.011546 -1.192801 -2.218493
H -4.853110 -2.207686 -1.001103
H -3.070392 -2.271782 -1.155642
H -4.051166 -0.153728 2.002728
H -5.227113 0.747438 -1.058066
H -3.310585 -2.371730 2.794543
H -3.078768 -2.959472 1.041399


