%chk=000212498.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212498

0 1
I 0.465412 2.092899 0.842448
I -3.666259 -2.356425 0.184920
I 2.125622 -3.744271 0.631773
O 2.366358 -0.872658 0.581547
O -4.082018 1.947658 0.886871
O 3.634253 2.115374 -1.057095
O 2.303607 0.530662 -1.920151
N -2.321468 0.727241 0.135580
C -1.331274 -0.297343 0.314733
C -2.404594 1.350257 -1.225744
C 0.030596 0.070805 0.487131
C 1.005658 -0.930354 0.513165
C -1.689626 -1.653406 0.315731
C 3.166726 0.331473 0.408976
C -3.228247 1.124481 1.153273
C 0.617262 -2.296779 0.503272
C -0.712696 -2.655542 0.418181
C -3.199990 0.490838 -2.199823
C 4.575377 -0.225340 0.519765
C -3.017369 0.532184 2.511961
C 2.933440 0.932281 -0.977346
H -2.893330 2.348265 -1.102458
H -1.373233 1.525628 -1.606277
H 2.924944 1.059948 1.220538
H -1.003090 -3.715128 0.420377
H -2.733178 -0.487106 -2.369348
H -4.217941 0.302097 -1.829966
H -3.291822 0.988170 -3.172092
H 4.741158 -1.054403 -0.186743
H 4.758027 -0.636851 1.523462
H 5.326118 0.553112 0.323704
H -1.984819 0.649372 2.869622
H -3.265937 -0.541231 2.538933
H -3.674864 1.029056 3.243650
H 3.526600 2.564539 -1.939272


%chk=000212498-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212498

0 1
I 0.254463 2.157939 1.268780
I -3.518314 -2.437148 -0.455007
I 2.331198 -3.619410 0.637826
O 2.357714 -0.446382 1.049932
O -4.240715 1.787563 1.116001
O 4.009186 1.002868 -1.935184
O 2.649495 -0.879303 -1.780825
N -2.416845 0.683582 0.199641
C -1.362260 -0.282056 0.287080
C -2.494518 1.558466 -1.011105
C -0.031943 0.125078 0.626150
C 1.055269 -0.788492 0.662880
C -1.577048 -1.668344 0.048356
C 3.212762 0.459778 0.251615
C -3.331208 0.917365 1.247787
C 0.775110 -2.168136 0.459851
C -0.526538 -2.604860 0.158145
C -3.496958 1.066243 -2.071942
C 4.603674 0.366389 0.897210
C -3.149538 0.104033 2.523436
C 3.229714 0.076039 -1.231683
H -2.793263 2.560998 -0.658321
H -1.477801 1.626575 -1.438009
H 2.831934 1.497272 0.319524
H -0.719693 -3.666218 -0.006649
H -3.207909 0.084759 -2.484539
H -4.506153 0.982916 -1.636171
H -3.537579 1.794912 -2.903139
H 4.980124 -0.668751 0.845715
H 4.528625 0.659830 1.957026
H 5.305442 1.041357 0.381230
H -2.108375 0.141527 2.890149
H -3.416620 -0.955965 2.362368
H -3.821127 0.522287 3.287444
H 4.019099 0.766794 -2.902274


