%chk=000242662.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242662

0 1
S -1.894279 -1.410440 1.299312
N 2.603677 -0.903882 -0.766345
N 0.927707 -2.311789 -0.045524
N 1.538353 1.282380 -0.181479
N -0.713859 0.957496 0.820717
N 0.150741 3.117898 0.366015
N -5.351001 -0.837420 0.970665
C 4.905486 -0.129256 -0.134541
C 3.913254 -0.464551 -1.278579
C 5.361726 -1.406847 0.596564
C 6.092191 0.635142 -0.728693
C 1.595492 -0.084313 -0.262801
C 6.096430 -1.097928 1.898526
C 2.144990 -2.254388 -0.592963
C 0.542851 -0.981267 0.179202
C -0.609959 -0.380317 0.727728
C 0.351845 1.742503 0.344360
C -3.182124 -0.291631 1.912714
C -4.199117 -0.119523 0.831915
C -3.977071 0.742259 -0.261518
C -4.964958 0.849010 -1.240944
C -6.300719 -0.719237 0.007300
C -6.146677 0.110934 -1.114136
H 4.380914 0.537633 0.597514
H 3.751250 0.444873 -1.908881
H 4.325962 -1.253116 -1.944272
H 4.481204 -2.041212 0.824202
H 6.010731 -2.012173 -0.064790
H 5.776050 1.576805 -1.192093
H 6.625499 0.049899 -1.485193
H 6.820282 0.890772 0.051732
H 5.467604 -0.525861 2.591309
H 6.391368 -2.020245 2.412609
H 7.007650 -0.514471 1.723836
H 2.746078 -3.098048 -0.901378
H -2.764372 0.684031 2.242797
H -3.618244 -0.771613 2.819741
H 0.951703 3.718249 0.227822
H -0.590334 3.482899 0.946805
H -3.045709 1.304311 -0.337863
H -4.815760 1.503089 -2.099919
H -7.207976 -1.316136 0.155580
H -6.928379 0.175781 -1.865251


%chk=000242662-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242662

0 1
S -1.912717 -1.720901 1.112932
N 2.689789 -0.993137 -0.812722
N 1.039928 -2.487185 -0.217931
N 1.574262 1.122197 -0.188141
N -0.680556 0.730979 0.724782
N 0.194787 2.892650 0.503866
N -5.492121 -0.706648 1.036387
C 4.940967 -0.045273 -0.137952
C 3.983240 -0.470105 -1.285858
C 5.322423 -1.253973 0.755869
C 6.178108 0.645727 -0.757788
C 1.637464 -0.229724 -0.309029
C 6.121378 -0.871985 2.020928
C 2.271615 -2.337665 -0.730105
C 0.619541 -1.170532 0.052515
C -0.568451 -0.614798 0.593746
C 0.377664 1.536343 0.339241
C -3.175837 -0.455307 1.786633
C -4.268246 -0.137542 0.795744
C -4.031381 0.713276 -0.317028
C -5.089543 0.982607 -1.209796
C -6.504935 -0.435918 0.161448
C -6.355253 0.396043 -0.970686
H 4.398343 0.695608 0.484021
H 3.776759 0.400807 -1.934339
H 4.458155 -1.255679 -1.904037
H 4.397241 -1.777636 1.068208
H 5.907858 -1.978823 0.150672
H 5.883512 1.506376 -1.387269
H 6.751735 -0.060217 -1.390087
H 6.858323 1.023707 0.024764
H 5.569301 -0.127256 2.624812
H 6.295793 -1.757812 2.658360
H 7.108509 -0.442392 1.772497
H 2.909840 -3.153190 -1.064851
H -2.574145 0.431737 2.042730
H -3.601158 -0.930844 2.681891
H 0.942829 3.527918 0.241316
H -0.669400 3.231844 0.915687
H -3.031700 1.135447 -0.461805
H -4.932833 1.634937 -2.075871
H -7.467678 -0.909136 0.387758
H -7.202910 0.575776 -1.639711


