%chk=000295653.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295653

0 1
O -2.644407 -2.294403 1.041985
N 0.111534 2.097961 0.121754
N 2.026177 -1.155714 0.427864
N -4.349445 -2.732004 -0.377916
C 0.224749 0.683660 0.637638
C -0.863631 -0.139874 -0.074353
C -2.261805 0.389118 0.307344
C 1.610601 0.189799 0.350780
C -1.200280 2.688928 0.537531
C 1.261859 2.957818 0.559648
C -2.351758 1.869985 -0.012217
C 2.696308 0.998110 0.036312
C 2.559819 2.466900 -0.122025
C -3.353017 -0.459696 -0.377143
C 3.848739 0.148802 -0.106690
C 3.402156 -1.198233 0.141151
C -3.368867 2.434578 -0.678633
C -3.392735 -1.872887 0.167264
C 5.202468 0.372739 -0.413932
C 4.283367 -2.296301 0.084947
C -3.494822 3.886571 -0.997217
C 6.063886 -0.710594 -0.467729
C 5.607041 -2.031185 -0.220427
C -4.455872 -4.122171 0.118481
C -5.298995 -2.328415 -1.433580
H 0.062849 0.629570 1.751142
H -0.714082 -0.080706 -1.170659
H -0.785737 -1.208537 0.208216
H -2.392396 0.273475 1.418193
H -1.240439 3.727032 0.124171
H -1.316466 2.780957 1.641237
H 1.398620 2.967632 1.661984
H 1.055478 4.001862 0.243157
H 3.432550 2.999480 0.301426
H 2.529599 2.714998 -1.205875
H -3.177902 -0.475126 -1.473229
H -4.343441 0.021296 -0.229646
H 1.437869 -1.940659 0.627775
H -4.207916 1.839293 -1.041687
H 5.552177 1.384117 -0.604737
H 3.931256 -3.304031 0.274220
H -2.548652 4.434050 -0.860833
H -4.248231 4.365951 -0.357209
H -3.802314 4.037003 -2.041112
H 7.114600 -0.560050 -0.703891
H 6.324314 -2.848612 -0.275231
H -3.704616 -4.295643 0.917275
H -4.261628 -4.844191 -0.690353
H -5.452895 -4.312812 0.545864
H -4.765782 -1.964294 -2.329305
H -5.976385 -1.532970 -1.077071
H -5.925897 -3.178976 -1.749457


%chk=000295653-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295653

0 1
O -2.761906 -2.220122 1.256506
N 0.108554 2.122308 0.245532
N 2.022840 -1.124973 0.368408
N -4.366880 -2.754791 -0.335060
C 0.216116 0.692515 0.653386
C -0.883380 -0.129342 -0.057551
C -2.294060 0.408631 0.321775
C 1.615225 0.219515 0.359128
C -1.211243 2.677900 0.649122
C 1.252808 2.948783 0.712675
C -2.351650 1.904400 -0.002288
C 2.702458 1.034337 0.059116
C 2.559375 2.533901 -0.006396
C -3.415370 -0.436766 -0.313666
C 3.846569 0.166952 -0.139737
C 3.389952 -1.188160 0.064567
C -3.301867 2.480827 -0.791086
C -3.476825 -1.863839 0.262615
C 5.211464 0.387552 -0.463124
C 4.251726 -2.299679 -0.046758
C -3.443721 3.937197 -1.180457
C 6.076553 -0.719603 -0.575466
C 5.602466 -2.049000 -0.370210
C -4.445171 -4.137629 0.167682
C -5.232938 -2.445221 -1.481949
H 0.028138 0.599530 1.762041
H -0.727367 -0.060312 -1.150653
H -0.823394 -1.187424 0.254705
H -2.379484 0.292947 1.424616
H -1.232764 3.741617 0.361362
H -1.337585 2.634636 1.766425
H 1.396846 2.861310 1.820873
H 1.019271 4.006727 0.490922
H 3.419073 3.041377 0.474766
H 2.522242 2.879634 -1.058532
H -3.280787 -0.470712 -1.412859
H -4.394850 0.049670 -0.127954
H 1.417746 -1.921012 0.558598
H -4.080729 1.833328 -1.219757
H 5.588197 1.404132 -0.625179
H 3.892763 -3.323202 0.111259
H -2.634851 4.575087 -0.787721
H -4.405142 4.351106 -0.816561
H -3.448991 4.044698 -2.282894
H 7.132078 -0.561754 -0.824863
H 6.299522 -2.889392 -0.464763
H -3.743409 -4.237971 1.009074
H -4.172679 -4.858693 -0.627454
H -5.470471 -4.367332 0.516029
H -4.869476 -2.937760 -2.406696
H -5.288364 -1.363068 -1.663217
H -6.259027 -2.809258 -1.283128


