%chk=000191534.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191534

0 1
O -2.206653 -0.342644 -2.145535
O 3.230735 -2.567913 -0.022618
O 4.380053 1.925508 1.149168
N -2.755861 -0.695536 0.636769
N 3.245186 0.102245 0.436225
C -2.357441 0.636579 0.111191
C -1.475093 0.414509 -1.155267
C -3.548428 1.563777 -0.236983
C -0.227216 -0.386224 -0.860455
C 0.933076 0.269065 -0.351262
C -3.546372 -0.630441 1.904263
C 2.085696 -0.499812 -0.073447
C -0.222181 -1.753921 -1.083212
C -3.122398 3.011339 -0.446954
C 2.054765 -1.911932 -0.321096
C 1.002654 1.695535 -0.095017
C 0.925475 -2.532396 -0.819022
C -4.192447 -1.984448 2.188089
C 2.120689 2.271671 0.397084
C 3.329922 1.500257 0.702049
H -1.725324 1.129859 0.896946
H -1.218046 1.397861 -1.618089
H -4.295786 1.515622 0.584627
H -4.077983 1.185348 -1.132700
H -3.254995 -1.227001 -0.085245
H -2.833176 -0.369913 2.720053
H -4.324677 0.167559 1.891318
H -1.122811 -2.240596 -1.469785
H -3.989854 3.651430 -0.653316
H -2.626594 3.421867 0.441398
H -2.433044 3.122695 -1.291824
H -2.995159 0.164589 -2.430136
H 0.118822 2.299954 -0.315196
H 0.902984 -3.603248 -1.004335
H 4.060970 -0.491478 0.626710
H -4.965252 -2.238463 1.454702
H -3.445558 -2.790963 2.169768
H -4.659555 -1.995847 3.179392
H 2.198359 3.341184 0.597694
H 3.158619 -3.539180 -0.195653


%chk=000191534-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191534

0 1
O -2.364865 -0.389478 -2.222207
O 3.189110 -2.614945 0.066256
O 4.283068 1.859866 1.419489
N -2.908471 -0.600743 0.554506
N 3.097948 0.034277 0.564958
C -2.431668 0.682008 0.023570
C -1.565383 0.389515 -1.249062
C -3.558191 1.727417 -0.270941
C -0.309051 -0.412075 -0.940381
C 0.829291 0.226079 -0.344390
C -3.554897 -0.626167 1.874863
C 1.980136 -0.558952 -0.019570
C -0.259183 -1.787976 -1.214094
C -3.050185 3.157396 -0.565618
C 1.998044 -1.952809 -0.298509
C 0.919161 1.645991 -0.044600
C 0.888585 -2.561763 -0.899932
C -3.768416 -2.076531 2.345650
C 2.041005 2.203879 0.529737
C 3.223794 1.406178 0.882837
H -1.759152 1.129889 0.785746
H -1.283939 1.357356 -1.712458
H -4.221902 1.760593 0.614571
H -4.197120 1.366953 -1.106678
H -3.364244 -1.178214 -0.161746
H -2.888540 -0.101855 2.589647
H -4.536379 -0.088809 1.907585
H -1.122074 -2.259600 -1.687310
H -3.893017 3.864529 -0.670175
H -2.409953 3.524789 0.259159
H -2.460425 3.211958 -1.499707
H -3.079290 0.194709 -2.580031
H 0.074317 2.297676 -0.292285
H 0.901550 -3.635862 -1.124162
H 3.899812 -0.568649 0.780282
H -4.434699 -2.625072 1.652151
H -2.802849 -2.609681 2.385310
H -4.233030 -2.100859 3.348128
H 2.109176 3.273205 0.747558
H 3.148025 -3.577726 -0.147847


