%chk=000192281.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192281

0 1
S 2.964295 0.971198 -1.170394
O -3.394817 1.452016 0.021795
N -1.176600 2.007099 -0.062475
N 0.133305 1.705601 -0.055721
N 4.114928 -0.492582 0.618268
C -0.429010 -0.680281 0.061177
C -1.802299 -0.356486 0.072468
C 0.520440 0.436969 0.013216
C -2.248299 1.047516 0.015561
C -0.041117 -2.036495 0.080097
C -2.773552 -1.379138 0.127042
C 1.955362 0.216597 0.035125
C -1.005811 -3.033747 0.131065
C -2.376224 -2.707525 0.159893
C -1.480739 3.461882 -0.142214
C 2.735813 -0.506361 0.901369
C 4.395253 0.235280 -0.438558
H 1.017076 -2.298996 0.043974
H -3.832268 -1.101702 0.140540
H -0.705234 -4.082869 0.147158
H -3.119188 -3.503522 0.203969
H -1.095023 3.890011 -1.083242
H -1.022710 4.004486 0.702804
H -2.578951 3.606278 -0.106734
H 2.401867 -1.067694 1.769529
H 5.387302 0.395265 -0.843908


%chk=000192281-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192281

0 1
S 3.077449 1.383690 -0.876518
O -3.455264 1.463926 0.148788
N -1.187596 1.999282 -0.120304
N 0.155136 1.694671 -0.142968
N 4.164123 -0.602899 0.532893
C -0.426446 -0.687090 0.069539
C -1.813818 -0.337492 0.151426
C 0.541240 0.411278 -0.027530
C -2.250508 1.072843 0.074054
C -0.076222 -2.069313 0.042402
C -2.806436 -1.344058 0.264127
C 1.997022 0.216772 -0.005829
C -1.068909 -3.057733 0.145184
C -2.438085 -2.698711 0.274027
C -1.482427 3.438216 -0.267299
C 2.776958 -0.725335 0.666790
C 4.484128 0.427078 -0.233712
H 0.966894 -2.364468 -0.093210
H -3.851899 -1.026570 0.328975
H -0.784295 -4.115121 0.117675
H -3.202497 -3.477741 0.360829
H -1.114389 3.794017 -1.243615
H -0.981463 4.003088 0.535515
H -2.572004 3.566214 -0.200591
H 2.390169 -1.506267 1.320965
H 5.502939 0.724522 -0.479809


