%chk=000242651.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242651

0 1
S 1.613404 -0.344730 -0.238496
F 4.246813 -0.453805 2.264996
O -5.502472 -1.168579 -0.807760
N -3.366560 -0.241896 -0.610294
N -1.427463 -1.478653 -0.762141
N -2.339947 1.963400 0.021041
N 0.098096 1.831604 0.169864
C -4.828016 0.078113 -0.655662
C -5.332951 0.720408 0.645652
C -5.960335 -0.431741 1.446550
C -6.018909 -1.622925 0.482790
C -2.317641 0.629888 -0.305891
C -2.760546 -1.512652 -0.877212
C -1.104034 -0.160121 -0.407547
C 0.105657 0.518498 -0.147975
C -1.113199 2.494133 0.240651
C 2.863840 0.921016 0.173341
C 4.160889 0.215646 -0.001332
C 4.807327 -0.451914 1.054471
C 4.792960 0.187594 -1.256878
C 6.025521 -1.120506 0.904521
C 6.010537 -0.474446 -1.431972
C 6.625479 -1.126382 -0.356993
H -5.038469 0.648306 -1.591306
H -6.075489 1.507442 0.417670
H -4.529835 1.232048 1.211945
H -5.353599 -0.669511 2.339583
H -6.963125 -0.159001 1.819333
H -5.384581 -2.469186 0.790013
H -7.039017 -1.966689 0.248367
H -3.366298 -2.371015 -1.148057
H -1.063461 3.563127 0.504730
H 2.697228 1.311881 1.198227
H 2.758533 1.802291 -0.493430
H 4.322053 0.686583 -2.105477
H 6.494128 -1.626566 1.747575
H 6.482589 -0.484976 -2.413514
H 7.574591 -1.641782 -0.502283


%chk=000242651-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242651

0 1
S 1.567735 -0.704679 -0.180243
F 4.504614 -0.394256 2.393161
O -5.698091 -1.065165 -0.893278
N -3.449617 -0.291891 -0.596879
N -1.585895 -1.633183 -0.766774
N -2.344265 1.838944 0.063578
N 0.088690 1.589708 0.243386
C -4.883720 0.127562 -0.726250
C -5.395757 0.822004 0.550505
C -5.778224 -0.384053 1.446700
C -6.325303 -1.410842 0.429956
C -2.355788 0.518188 -0.277774
C -2.924823 -1.562001 -0.892241
C -1.207782 -0.335486 -0.383253
C 0.044761 0.268092 -0.095107
C -1.083377 2.299143 0.303643
C 2.837750 0.653546 0.302326
C 4.227083 0.136585 0.041694
C 5.034124 -0.373531 1.083154
C 4.798958 0.142073 -1.258155
C 6.339784 -0.855171 0.895512
C 6.106949 -0.336408 -1.486993
C 6.878463 -0.835719 -0.410261
H -4.982587 0.735525 -1.640942
H -6.290704 1.413777 0.286841
H -4.643824 1.494188 0.990286
H -4.885624 -0.777377 1.963543
H -6.528346 -0.115967 2.208341
H -6.057853 -2.454760 0.666504
H -7.418491 -1.331446 0.292714
H -3.574486 -2.378933 -1.192907
H -0.991678 3.353712 0.578224
H 2.661697 0.889257 1.360624
H 2.585303 1.532082 -0.309312
H 4.198685 0.523264 -2.092039
H 6.907580 -1.232644 1.750744
H 6.524133 -0.321374 -2.499035
H 7.893624 -1.207864 -0.582890


