%chk=000237939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237939

0 1
S 1.223532 -2.565631 0.037767
S 0.560814 2.764109 -0.281543
N -1.446635 1.068047 -0.157885
N 0.773201 0.073312 -0.119212
C -2.003522 -0.178828 -0.076112
C -1.197824 -1.335968 -0.013467
C 0.190162 -1.153589 -0.038368
C -3.489786 -0.261814 -0.056086
C -0.084435 1.136145 -0.175641
C 2.905602 -1.925490 -0.018362
C 2.345455 2.524393 -0.285126
H -1.645109 -2.323714 0.051215
H -3.852168 -0.738190 0.867056
H -3.960502 0.735749 -0.113189
H -3.869989 -0.848163 -0.905836
H 3.593899 -2.778714 0.027649
H 3.112898 -1.252753 0.824971
H 3.095494 -1.362028 -0.942042
H 2.675969 1.916703 -1.137936
H 2.694088 2.025046 0.628614
H 2.815656 3.513778 -0.350568


%chk=000237939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237939

0 1
S 1.256556 -2.634204 0.041531
S 0.566959 2.812585 -0.282379
N -1.467935 1.070225 -0.156197
N 0.755655 0.070742 -0.117517
C -2.028471 -0.180019 -0.075429
C -1.219904 -1.342854 -0.013314
C 0.184637 -1.163111 -0.037610
C -3.538284 -0.258428 -0.056239
C -0.106211 1.125853 -0.173185
C 2.957964 -1.842202 -0.023715
C 2.411768 2.458295 -0.282199
H -1.666476 -2.338396 0.050972
H -3.897871 -0.746513 0.868314
H -3.960657 0.755900 -0.112890
H -3.914967 -0.852617 -0.909121
H 3.671983 -2.679469 0.020193
H 3.089731 -1.170163 0.835519
H 3.071935 -1.279678 -0.960674
H 2.674441 1.832759 -1.146886
H 2.697626 1.949600 0.649217
H 2.898322 3.444096 -0.352492


