%chk=000224212.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224212

0 1
S -4.839983 0.585623 0.612321
S -6.134320 0.097512 -2.071966
N -7.438525 0.616809 0.164921
C 2.884017 0.167449 0.350802
C 4.141937 -0.065724 -0.496880
C 1.609015 0.054111 -0.495763
C 5.417333 0.047174 0.349211
C 0.351022 0.287425 0.351802
C 6.675296 -0.185601 -0.498543
C -0.922270 0.173595 -0.496593
C 7.950538 -0.073163 0.347453
C -2.181786 0.407399 0.353800
C 9.209737 -0.305542 -0.499543
C -3.430957 0.290033 -0.507789
C 10.482276 -0.194834 0.337458
C -6.256021 0.435710 -0.447196
C -7.547009 0.917463 1.609605
C -8.698936 0.518057 -0.608211
H 2.850289 -0.562834 1.182195
H 2.931902 1.165309 0.827924
H 4.176291 0.664479 -1.328353
H 4.094491 -1.063416 -0.974464
H 1.643733 0.784076 -1.327604
H 1.562035 -0.943804 -0.973225
H 5.465201 1.044754 0.826848
H 5.383644 -0.683347 1.180352
H 0.317473 -0.443041 1.183252
H 0.399182 1.285561 0.828683
H 6.627529 -1.183047 -0.976509
H 6.709361 0.545075 -1.329557
H -0.969478 -0.824727 -0.974129
H -0.887859 0.904041 -1.328562
H 7.918188 -0.803445 1.178637
H 7.999793 0.923680 0.826102
H -2.206341 -0.326513 1.185863
H -2.124288 1.407859 0.830587
H 9.162714 -1.303605 -0.977498
H 9.244441 0.425952 -1.330504
H -3.524666 -0.709568 -0.978863
H -3.442686 1.029090 -1.334549
H 10.497505 -0.932127 1.148111
H 11.375020 -0.362439 -0.275240
H 10.579511 0.796314 0.794800
H -8.599491 1.030293 1.917183
H -7.107980 0.104230 2.219899
H -7.024778 1.861364 1.860459
H -9.576729 0.690153 0.030527
H -8.709940 1.259686 -1.432802
H -8.792131 -0.483103 -1.076249


%chk=000224212-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224212

0 1
S -5.002283 0.541080 0.750482
S -6.151849 0.334342 -2.163403
N -7.624341 0.646757 0.109689
C 2.928029 0.171621 0.366692
C 4.195574 -0.127847 -0.464809
C 1.616062 0.001436 -0.431743
C 5.507953 0.065449 0.327652
C 0.349660 0.281277 0.408198
C 6.776001 -0.241584 -0.500605
C -0.960672 0.149957 -0.400865
C 8.088895 -0.037377 0.288342
C -2.222500 0.391249 0.463129
C 9.356780 -0.345085 -0.540716
C -3.504739 0.308927 -0.382208
C 10.663963 -0.136939 0.254225
C -6.389560 0.511701 -0.479457
C -7.781774 0.789668 1.574331
C -8.826330 0.646310 -0.753993
H 2.906845 -0.495542 1.254098
H 2.984728 1.208417 0.759909
H 4.209243 0.528129 -1.360640
H 4.146801 -1.169927 -0.844804
H 1.631655 0.680860 -1.309772
H 1.565370 -1.030120 -0.838866
H 5.558986 1.109684 0.701579
H 5.492316 -0.585141 1.227395
H 0.321007 -0.417822 1.270229
H 0.413318 1.302786 0.838005
H 6.728773 -1.288165 -0.868472
H 6.787996 0.403933 -1.404088
H -1.013090 -0.860838 -0.855326
H -0.945006 0.871663 -1.243560
H 8.078892 -0.682006 1.192495
H 8.137940 1.009514 0.655187
H -2.255086 -0.359416 1.277889
H -2.153728 1.386327 0.945693
H 9.307311 -1.391159 -0.906653
H 9.365667 0.299016 -1.443976
H -3.622100 -0.667890 -0.879219
H -3.557475 1.095837 -1.152135
H 10.696778 -0.795153 1.143177
H 11.554452 -0.358243 -0.362752
H 10.749503 0.907747 0.608876
H -8.851997 0.871484 1.815658
H -7.363789 -0.086360 2.104858
H -7.264103 1.694899 1.943444
H -9.720742 0.760411 -0.121271
H -8.776624 1.472219 -1.486029
H -8.889411 -0.295688 -1.327666


