%chk=000270833.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270833

0 1
S 8.044846 -2.004873 -0.208003
F 8.174226 -1.902836 -2.056697
O 3.267174 3.050076 0.712685
O 9.249855 -1.116509 0.363515
O 7.894233 -3.566983 0.121594
N -4.869410 -0.440458 -0.077247
N -5.259425 -2.876928 0.217206
N -7.084420 -1.245349 0.423597
N -6.706806 1.043459 0.216488
N -7.382632 -3.484940 1.004493
N 2.706370 0.785999 0.417866
C -4.394926 -1.876099 -0.411024
C -3.942276 0.662840 -0.076371
C -4.411590 -2.089166 -1.954212
C -2.961193 -2.055284 0.138532
C -1.039160 3.947859 0.022480
C -2.072098 2.829022 -0.006380
C -6.218759 -0.249363 0.189279
C 0.405037 3.453649 -0.262162
C -3.572204 1.260373 1.157378
C -3.389587 1.176030 -1.279203
C -2.654765 2.330691 1.187892
C -2.458909 2.235625 -1.236445
C 0.901167 2.437222 0.798478
C -6.502823 -2.531170 0.520404
C 2.391620 2.136212 0.636758
C 3.978389 0.184309 0.281898
C 4.016266 -1.223746 0.065412
C 5.193511 0.925127 0.359030
C 6.416619 -1.127356 -0.008172
C 5.239689 -1.893286 -0.089033
C 6.423943 0.260099 0.208901
H -4.200839 -3.153328 -2.156272
H -5.409730 -1.851319 -2.361753
H -3.645893 -1.475147 -2.459727
H -2.658017 -3.097742 -0.048553
H -2.246873 -1.373089 -0.354624
H -2.944196 -1.879366 1.227270
H -1.296963 4.716156 -0.731645
H -1.057494 4.448653 1.009832
H 0.443506 2.988325 -1.266692
H 1.101335 4.312314 -0.267705
H -3.998581 0.858629 2.083248
H -3.710255 0.758742 -2.238194
H -2.382100 2.781687 2.149793
H -2.039952 2.620042 -2.174830
H 0.278823 1.523323 0.781727
H 0.781004 2.897052 1.800369
H -6.120444 1.849285 0.024357
H -7.685536 1.149208 0.469932
H -8.304616 -3.184519 1.303084
H -7.058134 -4.436798 1.138784
H 1.904438 0.154183 0.351381
H 3.082476 -1.796025 0.011523
H 5.154111 2.002243 0.531304
H 5.280251 -2.974286 -0.252871
H 7.367716 0.812034 0.266224


%chk=000270833-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270833

0 1
S 8.064486 -2.029699 -0.120423
F 7.983678 -2.317243 -1.958459
O 3.267629 3.066738 0.270931
O 9.301285 -1.029510 0.108851
O 7.998608 -3.490982 0.547279
N -4.854597 -0.439212 -0.124493
N -5.170759 -2.881712 0.172556
N -7.031379 -1.302894 0.443710
N -6.698041 1.000181 0.313800
N -7.227636 -3.534388 1.094161
N 2.749939 0.792724 0.545648
C -4.425282 -1.856530 -0.576712
C -3.935735 0.667088 -0.073469
C -4.725469 -2.007500 -2.094378
C -2.926179 -2.056170 -0.282399
C -1.054360 3.971190 0.143448
C -2.075444 2.842951 0.073374
C -6.198118 -0.282477 0.208279
C 0.388863 3.520463 -0.214019
C -3.560289 1.214878 1.181166
C -3.382743 1.226584 -1.256028
C -2.648835 2.290499 1.248244
C -2.461136 2.291904 -1.177461
C 0.942828 2.460017 0.767155
C -6.409995 -2.569245 0.533721
C 2.418590 2.158764 0.499109
C 4.016579 0.183934 0.381499
C 4.077454 -1.236373 0.487359
C 5.202819 0.930926 0.124611
C 6.444503 -1.142579 0.078356
C 5.296746 -1.915066 0.330978
C 6.428725 0.257789 -0.033616
H -4.505098 -3.044809 -2.401094
H -5.793350 -1.808554 -2.294360
H -4.109216 -1.322100 -2.704903
H -2.675081 -3.098434 -0.538357
H -2.287770 -1.375534 -0.871370
H -2.726928 -1.911309 0.793114
H -1.341233 4.781412 -0.554922
H -1.052348 4.413141 1.158744
H 0.406167 3.113058 -1.243509
H 1.065997 4.393721 -0.203510
H -3.986061 0.784738 2.094196
H -3.685347 0.829194 -2.230249
H -2.374981 2.704339 2.226701
H -2.046857 2.712498 -2.102408
H 0.324409 1.543004 0.731847
H 0.869857 2.857406 1.800340
H -6.159256 1.814221 0.031297
H -7.665285 1.090993 0.613850
H -8.144631 -3.262568 1.434713
H -6.882946 -4.485342 1.184902
H 1.970149 0.154451 0.723020
H 3.166547 -1.812335 0.688866
H 5.145247 2.017674 0.048902
H 5.356784 -3.004247 0.414334
H 7.350498 0.814835 -0.228019


