%chk=000286046.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286046

0 1
O 4.892561 1.825137 -0.575912
O 6.375018 -1.435002 1.361743
N -3.490744 0.038833 0.187031
N 2.976726 -0.061211 -0.033507
N 4.320497 -0.346748 0.008429
C -6.415057 0.552401 0.108117
C -7.645673 0.993049 0.944634
C -6.850147 0.330569 -1.361022
C -5.352616 1.680726 0.182076
C -5.793087 -0.725055 0.720142
C -8.827720 0.024339 0.816617
C -8.031595 -0.639221 -1.489251
C -4.013232 1.283041 -0.453117
C -4.449624 -1.101427 0.080517
C -9.229872 -0.177325 -0.650101
C -2.105676 -0.226584 0.129178
C -1.603044 -1.518934 0.428643
C -1.176535 0.814523 -0.123306
C -0.233708 -1.748388 0.479498
C 0.189617 0.571198 -0.070656
C 0.684356 -0.712949 0.227799
C 2.124943 -1.000466 0.285691
C 5.233541 0.702833 -0.270504
C 6.677695 0.302269 -0.222995
C 7.240810 -0.702738 0.581090
C 7.555517 1.051255 -1.029812
C 8.619542 -0.970992 0.597346
C 8.926231 0.793920 -1.037390
C 9.456308 -0.214216 -0.222143
H -7.964805 2.001033 0.616586
H -7.363461 1.096914 2.008417
H -5.996805 -0.044055 -1.955803
H -7.126552 1.304557 -1.808192
H -5.180743 1.946630 1.244955
H -5.727754 2.598388 -0.305904
H -6.494822 -1.574126 0.618876
H -5.647996 -0.572632 1.808303
H -9.689028 0.410856 1.393589
H -8.569536 -0.950259 1.273201
H -7.721773 -1.654216 -1.173946
H -8.327109 -0.727298 -2.551623
H -4.126644 1.147282 -1.551701
H -3.278000 2.109113 -0.303407
H -4.027291 -1.987178 0.610494
H -4.595474 -1.398539 -0.982301
H -10.049580 -0.915815 -0.720489
H -9.632955 0.767995 -1.061325
H -2.290557 -2.336482 0.636578
H -1.529133 1.820318 -0.346595
H 0.127611 -2.749308 0.715776
H 0.894825 1.386089 -0.266122
H 2.386448 -2.020977 0.603230
H 4.663193 -1.263813 0.332635
H 7.137869 1.853644 -1.650798
H 9.026218 -1.749986 1.234323
H 9.585157 1.382829 -1.673170
H 10.530066 -0.408909 -0.225983
H 6.846100 -2.078993 1.947458


%chk=000286046-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000286046

0 1
O 5.140142 2.047671 -0.409604
O 6.248460 -2.021698 0.370645
N -3.511789 0.122192 0.049655
N 3.047307 0.214770 -0.056707
N 4.386659 -0.138451 0.003558
C -6.488296 0.562891 0.043581
C -7.715339 1.160502 0.796117
C -6.977752 -0.026116 -1.317229
C -5.450689 1.696465 -0.190021
C -5.778675 -0.505440 0.923856
C -8.893925 0.170812 0.953449
C -8.157501 -1.019059 -1.176038
C -4.115244 1.197747 -0.775538
C -4.429069 -0.996299 0.354843
C -9.345383 -0.380611 -0.419415
C -2.119500 -0.100083 0.029713
C -1.562323 -1.403730 0.229007
C -1.193359 0.982678 -0.153089
C -0.170903 -1.601085 0.260692
C 0.189682 0.775291 -0.125877
C 0.739230 -0.524913 0.084293
C 2.178221 -0.765928 0.120015
C 5.379189 0.826915 -0.179836
C 6.805505 0.315910 -0.088043
C 7.230776 -1.018141 0.169558
C 7.819717 1.290834 -0.283304
C 8.601401 -1.358344 0.228846
C 9.188951 0.968329 -0.228363
C 9.582881 -0.365515 0.029553
H -8.071821 2.048244 0.230777
H -7.390863 1.528089 1.790963
H -6.144735 -0.518348 -1.854831
H -7.305379 0.819531 -1.958613
H -5.247563 2.197634 0.777894
H -5.872998 2.458597 -0.875498
H -6.425104 -1.389453 1.078193
H -5.592733 -0.062168 1.922821
H -9.739129 0.677226 1.458920
H -8.596882 -0.672758 1.609142
H -7.826867 -1.929890 -0.636793
H -8.479952 -1.352739 -2.181651
H -4.270995 0.827972 -1.815028
H -3.417325 2.045062 -0.844998
H -3.956717 -1.639302 1.116935
H -4.596835 -1.628809 -0.548708
H -10.161316 -1.117953 -0.290274
H -9.756914 0.451771 -1.027832
H -2.212965 -2.275650 0.333901
H -1.560300 2.004201 -0.288442
H 0.218285 -2.616954 0.410446
H 0.880204 1.615233 -0.255174
H 2.499181 -1.813384 0.302680
H 4.687669 -1.112647 0.187402
H 7.476198 2.312090 -0.479814
H 8.900731 -2.395698 0.430347
H 9.942998 1.746094 -0.384397
H 10.643488 -0.634696 0.076257
H 6.662765 -2.902989 0.536950


