%chk=000209049.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209049

0 1
S -1.021314 -1.602014 0.643713
O -0.399581 2.204789 0.473978
N -2.297982 0.986809 0.695172
N -0.892908 1.068958 0.492637
N 3.992904 -0.371988 -0.361959
C -2.751131 -1.359705 0.074023
C -2.978377 0.101996 -0.313648
C -0.225864 -0.081671 0.342759
C -3.011539 -2.306573 -1.079098
C -2.949323 2.323879 0.823369
C 1.214521 -0.170367 0.100619
C 2.095089 0.821903 0.565225
C 1.746641 -1.261877 -0.610108
C 3.467912 0.682205 0.314957
C 3.132372 -1.322311 -0.814202
H -3.388948 -1.624967 0.955113
H -2.631835 0.303276 -1.353966
H -4.069546 0.326624 -0.303420
H -2.359102 -2.112571 -1.942296
H -2.840935 -3.354587 -0.790236
H -4.049512 -2.241545 -1.431931
H -3.052534 2.873011 -0.125238
H -2.359496 2.966325 1.509033
H -3.940623 2.169265 1.280420
H 1.715914 1.695413 1.100044
H 1.105589 -2.048889 -1.003331
H 4.184384 1.435461 0.663240
H 3.586021 -2.157448 -1.360371


%chk=000209049-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209049

0 1
S -1.115799 -1.685902 0.768272
O -0.387866 2.268374 0.640144
N -2.353407 0.947114 0.768355
N -0.909432 1.052944 0.636114
N 4.021172 -0.386972 -0.477720
C -2.827013 -1.365462 -0.057217
C -2.939013 0.141275 -0.339651
C -0.228201 -0.114974 0.457076
C -3.008111 -2.231651 -1.309851
C -2.989459 2.244613 1.074826
C 1.205329 -0.168796 0.146108
C 2.077577 0.965530 0.192038
C 1.807913 -1.412851 -0.222966
C 3.442402 0.800402 -0.124772
C 3.182934 -1.468801 -0.517296
H -3.534604 -1.649011 0.740552
H -2.433738 0.380251 -1.301275
H -4.002589 0.422464 -0.434746
H -2.251174 -1.980818 -2.074088
H -2.909759 -3.303922 -1.069510
H -4.013363 -2.076041 -1.748792
H -2.962484 2.958961 0.228162
H -2.474035 2.709231 1.927776
H -4.034398 2.031262 1.355356
H 1.689692 1.944270 0.471503
H 1.204069 -2.322364 -0.288828
H 4.116704 1.664149 -0.092800
H 3.647448 -2.419873 -0.802274


