%chk=000211496.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211496

0 1
I -0.403066 -1.870669 -2.025749
I 2.491027 2.374935 1.419166
I -3.355450 2.551098 1.041849
O 4.401254 0.393459 -0.996788
O 2.807907 1.580209 -2.016874
O -3.709951 -0.756649 1.291123
N -2.839746 -0.237621 -0.775388
C 2.156805 -0.336756 -0.616070
C 2.799135 -1.089602 0.566532
C 0.840927 0.299753 -0.226416
C 1.978734 -2.314434 0.986497
C -0.376681 -0.223861 -0.689888
C 3.079553 0.678827 -1.260339
C 0.787253 1.412712 0.627880
C 2.633856 -3.039584 2.159335
C -1.618949 0.327213 -0.300831
C -0.424531 1.994566 0.999551
C -1.623123 1.467185 0.525715
C -3.869853 -0.706070 0.094335
C -5.108931 -1.129627 -0.636415
H 1.988412 -1.105905 -1.439077
H 2.937018 -0.409553 1.433211
H 3.826660 -1.400066 0.278647
H 0.950128 -2.008113 1.266500
H 1.863674 -3.011998 0.133208
H 2.721205 -2.390544 3.038883
H 2.045428 -3.914747 2.458888
H 3.641245 -3.391268 1.909644
H -0.435570 2.875638 1.657875
H -2.875040 -0.459829 -1.777233
H 5.018340 1.038637 -1.437853
H -5.533789 -0.315918 -1.242199
H -5.885862 -1.428289 0.088426
H -4.938718 -1.991126 -1.295546


%chk=000211496-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211496

0 1
I -0.525426 -1.812108 -2.054991
I 2.549094 2.378592 1.530555
I -3.434750 2.614298 1.057080
O 4.417616 0.221996 -1.292738
O 2.697621 1.599985 -2.005810
O -3.631807 -0.964941 1.208308
N -2.890667 -0.071461 -0.819287
C 2.164126 -0.356183 -0.572862
C 2.844079 -1.141351 0.590747
C 0.848787 0.324110 -0.190901
C 1.976441 -2.298994 1.134896
C -0.410065 -0.140519 -0.672374
C 3.073940 0.618103 -1.330003
C 0.789983 1.439774 0.694988
C 2.672162 -3.030818 2.302648
C -1.661245 0.442682 -0.313826
C -0.423793 2.050279 1.068962
C -1.639736 1.562638 0.556306
C -3.818197 -0.767100 -0.021541
C -5.068780 -1.220456 -0.765246
H 1.929797 -1.119093 -1.345322
H 3.102244 -0.455649 1.417254
H 3.799874 -1.541028 0.206700
H 0.995868 -1.912970 1.475895
H 1.762143 -3.020151 0.320651
H 2.856623 -2.341877 3.148265
H 2.052267 -3.865382 2.676922
H 3.648023 -3.447213 1.988752
H -0.422139 2.913201 1.736882
H -3.039992 -0.051849 -1.830892
H 4.947396 0.847919 -1.857977
H -5.866078 -0.467010 -0.626602
H -5.420001 -2.166848 -0.326037
H -4.906108 -1.358569 -1.848800


