%chk=000210693.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210693

0 1
S -1.030800 -0.313498 -1.890819
S 0.686963 -0.520573 -3.062169
S 3.404978 -0.821746 -2.064881
N 1.244768 -0.670629 -0.475217
N -0.761082 -0.703230 0.807702
C 2.091472 -0.696140 0.765474
C 2.331406 0.701197 1.279967
C -0.177562 -0.581749 -0.325693
C -2.213506 -0.645579 0.993995
C 1.482933 1.240732 2.258245
C 3.407162 1.458515 0.794940
C -3.041987 -0.431222 -0.252208
C 1.816184 -0.664524 -1.722887
C 1.713674 2.528009 2.750069
C 3.632300 2.746435 1.289053
C -3.136252 0.850544 -0.821843
C -3.771704 -1.496924 -0.807230
C 2.788023 3.282195 2.266741
C -3.954196 1.058913 -1.940252
C -4.580992 -1.281909 -1.923184
C -4.672402 -0.004005 -2.491287
H 3.056267 -1.214825 0.540256
H 1.574218 -1.325329 1.530977
H -2.413535 0.169857 1.735919
H -2.503711 -1.596031 1.510627
H 0.640778 0.656376 2.631088
H 4.067245 1.046836 0.029105
H 1.055686 2.944022 3.510568
H 4.467407 3.332939 0.909118
H -2.600538 1.692107 -0.379148
H -3.700977 -2.492759 -0.370690
H 2.966479 4.284836 2.650648
H -4.026497 2.053935 -2.378205
H -5.142655 -2.109299 -2.355404
H -5.306647 0.158623 -3.361975


%chk=000210693-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210693

0 1
S -0.460157 -1.815569 -2.070182
S 1.734036 -1.999595 -2.921137
S 4.177490 -1.313791 -1.436330
N 1.628006 -1.175379 -0.332095
N -0.497932 -1.308528 0.688605
C 2.187437 -0.671633 0.970358
C 2.005898 0.829705 1.150887
C 0.215315 -1.402671 -0.384700
C -1.953231 -1.573062 0.677050
C 1.021063 1.330431 2.039133
C 2.835727 1.744966 0.452026
C -2.771124 -0.614285 -0.192934
C 2.472864 -1.435982 -1.390166
C 0.864278 2.722743 2.225205
C 2.675372 3.136260 0.633597
C -2.469751 0.772181 -0.231359
C -3.877049 -1.099958 -0.935028
C 1.689829 3.629352 1.520872
C -3.263064 1.652919 -0.997243
C -4.674547 -0.217147 -1.697972
C -4.369523 1.162562 -1.730943
H 3.257146 -0.948408 0.954430
H 1.666744 -1.230570 1.763745
H -2.289127 -1.497486 1.727630
H -2.144990 -2.616173 0.344868
H 0.376304 0.623906 2.573464
H 3.605459 1.363792 -0.229273
H 0.103327 3.098601 2.918459
H 3.321509 3.834476 0.089951
H -1.607756 1.154511 0.327549
H -4.111982 -2.171671 -0.920602
H 1.570047 4.709123 1.664663
H -3.016880 2.720323 -1.025325
H -5.524638 -0.605825 -2.269731
H -4.983200 1.847983 -2.326069


