%chk=000210956.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210956

0 1
O 2.019144 0.773723 -1.264060
N -1.783271 -0.430005 0.243583
N -4.528136 -1.160651 -0.317682
C -2.508389 0.136891 -0.943516
C -2.292367 -1.803292 0.554433
C -4.014256 0.214897 -0.626396
C -3.799915 -1.715776 0.870759
C -0.348949 -0.277923 0.164302
C 0.076758 1.140919 0.204907
C -5.997795 -1.121847 -0.057012
C 0.507060 -1.325514 0.151970
C 1.209729 1.609107 -0.483093
C 1.963055 -1.247920 0.144919
C -0.660125 2.087111 0.944132
C 2.671160 -0.238678 -0.534872
C 1.578423 2.962296 -0.500335
C 2.728232 -2.248245 0.775011
C -0.302101 3.435437 0.948068
C 0.806510 3.876746 0.213573
C 4.068346 -0.206382 -0.610037
C 4.122949 -2.232569 0.713816
C 4.793778 -1.220893 0.015717
H -2.345316 -0.482331 -1.854460
H -2.119580 1.154268 -1.163366
H -1.753801 -2.190937 1.446173
H -2.127625 -2.517741 -0.283185
H -4.188860 0.939836 0.197833
H -4.554459 0.593818 -1.520617
H -4.188181 -2.737720 1.069010
H -3.955226 -1.117181 1.794572
H -6.511298 -0.754983 -0.960617
H -6.305035 -0.496753 0.794046
H -6.356979 -2.148845 0.118741
H 0.131335 -2.351308 0.122713
H -1.528109 1.751196 1.518948
H 2.454962 3.270670 -1.066859
H 2.220575 -3.044653 1.317986
H -0.887067 4.148772 1.525426
H 1.072484 4.933372 0.208947
H 4.560627 0.594512 -1.157769
H 4.693512 -3.015550 1.210386
H 5.881101 -1.222076 -0.036694


%chk=000210956-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210956

0 1
O 2.158434 0.828219 -1.213554
N -1.755056 -0.486171 0.051233
N -4.566503 -1.116152 -0.217756
C -2.591419 0.150076 -1.005365
C -2.267644 -1.819219 0.426549
C -4.058578 0.232245 -0.559370
C -3.743759 -1.719974 0.853803
C -0.349443 -0.262280 0.010526
C 0.054808 1.174447 0.071514
C -6.005860 -1.117473 0.103810
C 0.548673 -1.312920 0.068514
C 1.261664 1.669754 -0.491635
C 2.011882 -1.254057 0.134800
C -0.777796 2.116427 0.742098
C 2.784890 -0.217157 -0.463193
C 1.604683 3.035980 -0.432126
C 2.739823 -2.327388 0.729542
C -0.444900 3.483647 0.814196
C 0.746658 3.952327 0.212605
C 4.191778 -0.229355 -0.458334
C 4.148782 -2.355866 0.742999
C 4.883079 -1.302835 0.147578
H -2.532994 -0.449464 -1.941306
H -2.203601 1.158358 -1.220759
H -1.673986 -2.204308 1.274925
H -2.182914 -2.541987 -0.418133
H -4.138261 0.936236 0.310426
H -4.667737 0.643158 -1.386058
H -4.125125 -2.736583 1.065792
H -3.802696 -1.125497 1.802702
H -6.577309 -0.712156 -0.750453
H -6.259579 -0.509694 1.009428
H -6.346780 -2.153346 0.281178
H 0.140087 -2.329428 0.100219
H -1.691120 1.740475 1.215462
H 2.539378 3.357027 -0.901745
H 2.174640 -3.148556 1.187238
H -1.108931 4.179452 1.338059
H 1.010007 5.014871 0.251003
H 4.724314 0.590076 -0.950894
H 4.673190 -3.196643 1.209823
H 5.978119 -1.320466 0.144058


