%chk=000190520.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190520

0 1
S -0.403225 -2.767943 -0.136939
F -2.696770 -3.454683 0.788558
F -2.566264 -3.479174 -1.313761
N 2.993695 0.905883 0.241785
N -1.508516 2.204799 -0.105097
N 0.748022 1.578466 0.073139
N -1.001469 -0.141114 -0.085831
N 1.336460 -0.811833 0.023175
C 4.115162 -0.085287 0.192493
C -2.983908 1.955598 -0.107578
C 5.261892 0.459790 1.047289
C 4.542916 -0.312461 -1.259663
C -3.658328 3.130188 -0.820681
C -3.490381 1.794163 1.328262
C 1.678508 0.548063 0.100469
C -0.582150 1.195147 -0.027830
C 0.007311 -1.051271 -0.059231
C -2.234099 -2.726023 -0.246514
H 3.744800 -1.056361 0.628163
H -3.175886 1.005840 -0.680296
H 3.226761 1.899091 0.228689
H -1.182348 3.164547 0.014943
H 6.079767 -0.270003 1.101877
H 5.687099 1.386104 0.645057
H 4.940214 0.660299 2.077491
H 3.715387 -0.732803 -1.849721
H 5.372964 -1.025673 -1.318359
H 4.864644 0.609487 -1.754528
H -4.737799 2.955582 -0.913321
H -3.534029 4.078274 -0.285065
H -3.265739 3.268291 -1.836570
H -3.009755 0.936907 1.821177
H -4.571218 1.615186 1.348565
H -3.292586 2.677093 1.945393
H -2.722932 -1.725070 -0.288040


%chk=000190520-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190520

0 1
S -0.362305 -2.819004 -0.126229
F -2.842390 -3.408978 0.826362
F -2.696359 -3.303013 -1.442560
N 2.989849 0.920481 0.220127
N -1.498971 2.186315 -0.059909
N 0.756120 1.597526 0.082913
N -0.974774 -0.117792 -0.072971
N 1.359008 -0.773217 0.042979
C 4.115561 -0.044308 0.231469
C -2.960809 1.959793 -0.137371
C 5.308880 0.596677 0.967553
C 4.483295 -0.489079 -1.203771
C -3.622858 3.210889 -0.748117
C -3.548942 1.608073 1.249932
C 1.674127 0.576787 0.110782
C -0.553353 1.202422 -0.012405
C 0.034989 -1.018507 -0.043165
C -2.228134 -2.690422 -0.242104
H 3.764565 -0.931297 0.788555
H -3.114907 1.097133 -0.811685
H 3.186431 1.923543 0.240891
H -1.141949 3.141881 0.007767
H 6.151476 -0.114559 1.012674
H 5.664771 1.501226 0.436576
H 5.038940 0.878546 2.000923
H 3.607374 -0.940759 -1.699146
H 5.290878 -1.243337 -1.175308
H 4.831895 0.369995 -1.806685
H -4.711216 3.055460 -0.842640
H -3.467632 4.097591 -0.103064
H -3.216525 3.429931 -1.751570
H -3.049001 0.717609 1.667685
H -4.629766 1.391930 1.165794
H -3.417713 2.448692 1.956021
H -2.522355 -1.629129 -0.212803


