%chk=000255528.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255528

0 1
O 8.221861 -1.890388 -0.012690
O -8.110266 0.988139 -0.237902
O 8.281681 0.324498 0.304158
O -8.169287 -1.226411 -0.557230
O 0.818491 -0.933831 1.379434
O -0.706459 0.032883 -1.630577
N 3.047462 0.037285 -0.016381
N -2.935382 -0.938479 -0.234875
N 1.772465 0.016119 -0.537541
N -1.660417 -0.917190 0.286343
C 5.389486 0.450333 -0.004073
C -5.277308 -1.352035 -0.247415
C 6.206301 -0.765380 -0.451451
C -6.094489 -0.136691 0.200247
C 4.055232 0.482672 -0.714317
C -3.943096 -1.384237 0.462902
C 4.029430 1.018167 -2.111255
C -3.917262 -1.920026 1.859729
C 7.633448 -0.644621 -0.009608
C -7.521449 -0.257449 -0.242181
C 0.740357 -0.487381 0.258219
C -0.628314 -0.413621 -0.509383
H 5.946421 1.393726 -0.199656
H 5.246807 0.421548 1.101978
H -5.134576 -1.322914 -1.353458
H -5.833994 -2.295651 -0.052173
H 6.181117 -0.885894 -1.557832
H 5.755768 -1.705272 -0.053043
H -6.069711 -0.016662 1.306693
H -5.643970 0.803481 -0.197538
H 3.608757 0.294943 -2.825240
H 3.433484 1.941532 -2.180040
H 5.032831 1.273721 -2.482401
H -3.321544 -2.843563 1.928204
H -4.920684 -2.175406 2.230937
H -3.496330 -1.197077 2.573829
H 1.559475 0.370073 -1.485192
H -1.447438 -1.271096 1.234013
H 9.176421 -1.867023 0.266219
H -9.064717 0.964780 -0.517154


%chk=000255528-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000255528

0 1
O 8.519764 -1.765599 -0.259450
O -8.407718 0.863915 0.008227
O 8.299876 0.416153 0.505328
O -8.187859 -1.317765 -0.756762
O 0.629708 -0.872313 1.528352
O -0.517653 -0.029596 -1.779762
N 3.062323 -0.063655 0.191070
N -2.950275 -0.838190 -0.442464
N 1.794064 -0.086354 -0.390121
N -1.682017 -0.815481 0.138734
C 5.426950 0.351522 0.081565
C -5.314921 -1.253275 -0.332973
C 6.353131 -0.746946 -0.497361
C -6.241049 -0.154720 0.245866
C 4.060639 0.340487 -0.571519
C -3.948617 -1.242263 0.320130
C 3.929878 0.782388 -2.021987
C -3.817909 -1.684035 1.770641
C 7.785517 -0.595103 -0.019217
C -7.673431 -0.306495 -0.232311
C 0.686188 -0.488197 0.324074
C -0.574133 -0.413685 -0.575475
H 5.911825 1.336319 -0.061520
H 5.301588 0.197196 1.166037
H -5.189537 -1.099032 -1.417455
H -5.799845 -2.238039 -0.189827
H 6.375140 -0.710178 -1.605398
H 5.990678 -1.755211 -0.231092
H -6.263077 -0.191408 1.353906
H -5.878533 0.853507 -0.020463
H 3.534051 -0.025678 -2.668965
H 3.244736 1.647830 -2.120558
H 4.906301 1.089235 -2.428626
H -3.132802 -2.549492 1.869311
H -4.794355 -1.990808 2.177281
H -3.422071 -0.875923 2.417556
H 1.601319 0.186400 -1.369572
H -1.489278 -1.088214 1.118191
H 9.459228 -1.633039 0.043938
H -9.347222 0.731342 -0.295030


