%chk=000244349.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244349

0 1
O 0.743153 2.682923 1.581790
N -0.552474 1.630251 -1.412564
C -0.263489 0.674666 0.811953
C 0.153287 -0.774410 0.760952
C -1.098087 1.045548 -0.406097
C 0.923232 1.647358 0.986641
C -2.543072 0.678754 -0.291856
C 2.259246 1.247454 0.448140
C -0.074875 -1.593546 1.877209
C 0.758726 -1.313882 -0.384342
C -3.490200 1.676920 -0.026289
C -2.945298 -0.652386 -0.459485
C 0.299205 -2.939921 1.844590
C 1.129881 -2.659993 -0.410904
C 3.149644 0.534990 1.262341
C 2.624506 1.618362 -0.851242
C 0.900044 -3.476100 0.701735
C -4.843330 1.339860 0.065533
C -4.300736 -0.982173 -0.369754
C 4.410818 0.190505 0.768657
C 3.888320 1.270278 -1.338017
C -5.249089 0.012149 -0.108115
C 4.780058 0.557900 -0.530112
H -0.918966 0.839207 1.717395
H -0.543708 -1.186651 2.771602
H 0.954760 -0.674489 -1.247640
H -3.172211 2.710241 0.113729
H -2.201839 -1.427133 -0.653510
H 0.121393 -3.571721 2.713491
H 1.604078 -3.072742 -1.300292
H 2.861258 0.249655 2.273053
H 1.920954 2.172268 -1.478914
H 1.190844 -4.524386 0.678703
H -1.127927 1.877432 -2.215510
H -5.582055 2.112722 0.273572
H -4.616950 -2.015993 -0.501679
H 5.106064 -0.363244 1.396794
H 4.176948 1.558079 -2.347331
H -6.304499 -0.247457 -0.037583
H 5.764087 0.289707 -0.911143


%chk=000244349-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244349

0 1
O 0.583136 1.706944 2.417975
N -0.432288 1.434353 -1.289637
C -0.283214 0.144974 0.793776
C 0.172742 -1.286700 0.463408
C -1.085568 0.836860 -0.318734
C 0.859528 1.055707 1.367511
C -2.583830 0.788498 -0.213125
C 2.239424 1.104365 0.787307
C 0.580869 -2.118037 1.540213
C 0.180715 -1.821196 -0.848174
C -3.364549 1.887002 -0.667134
C -3.247348 -0.353215 0.312145
C 1.002366 -3.444953 1.310257
C 0.593338 -3.153010 -1.079204
C 3.282445 1.575791 1.634587
C 2.547408 0.724917 -0.545703
C 1.009161 -3.969621 -0.003454
C -4.772697 1.840712 -0.607833
C -4.656900 -0.404485 0.356663
C 4.608032 1.647728 1.165923
C 3.875073 0.808123 -1.015235
C -5.424484 0.691567 -0.100979
C 4.909116 1.260075 -0.162807
H -0.960696 0.076845 1.665769
H 0.571430 -1.719337 2.562558
H -0.132198 -1.196664 -1.691919
H -2.866433 2.793509 -1.032343
H -2.663125 -1.212330 0.659917
H 1.320658 -4.069122 2.152846
H 0.590400 -3.551800 -2.100080
H 3.025456 1.879184 2.654817
H 1.740650 0.428880 -1.218252
H 1.332091 -5.000828 -0.184689
H -1.071693 1.852929 -1.999720
H -5.361029 2.701665 -0.943514
H -5.155752 -1.297251 0.749175
H 5.404867 2.003457 1.828391
H 4.102782 0.525127 -2.048831
H -6.518459 0.654829 -0.055820
H 5.940281 1.315509 -0.530549


