%chk=000259818.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259818

0 1
S -2.640586 0.524775 0.501704
F 0.517984 -1.707753 -2.590327
O 4.308821 1.124834 0.717515
O 5.232608 -1.881297 1.448736
O 6.102357 -1.170076 -0.794485
O 4.318286 2.724264 -1.965163
N 2.263569 0.180265 1.412034
N 0.192793 0.938409 2.099652
N 1.555746 -0.869427 -0.760053
N -0.884180 -0.669633 -1.127913
C 4.199891 -1.280100 0.694158
C 3.735478 0.019985 1.415875
C 4.724008 -0.792594 -0.688679
C 4.734986 0.748558 -0.628721
C 3.803975 1.431931 -1.637578
C 1.351606 -0.187883 0.417730
C 1.489818 0.885989 2.403726
C 0.053945 0.279352 0.866629
C -1.056172 0.004495 0.037736
C 0.397506 -1.058746 -1.446485
C -3.713721 -0.047724 -0.855193
C -5.074431 0.407552 -0.446640
C -5.541681 1.673199 -0.836764
C -5.894692 -0.427819 0.329055
C -6.817934 2.094808 -0.455502
C -7.169847 0.000352 0.706676
C -7.633717 1.260498 0.315564
H 3.414175 -2.065016 0.631589
H 4.113959 0.108956 2.464071
H 4.139672 -1.208989 -1.534433
H 5.774366 1.155982 -0.696618
H 2.773665 1.523606 -1.249151
H 3.791841 0.913066 -2.616723
H 6.110916 -1.443142 1.248995
H 6.175479 -2.124307 -1.031721
H 1.959259 1.303074 3.287127
H 4.264239 3.317643 -1.183246
H -3.639368 -1.147972 -0.978824
H -3.383093 0.377959 -1.825247
H -4.910396 2.329077 -1.434888
H -5.538518 -1.409223 0.639421
H -7.177084 3.077122 -0.759649
H -7.803335 -0.649980 1.308459
H -8.627591 1.591632 0.611350


%chk=000259818-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259818

0 1
S -2.743617 0.598290 0.887218
F 0.372768 -1.330437 -2.600807
O 4.223370 1.253672 0.427483
O 5.440048 -1.485750 1.582838
O 5.851313 -1.635265 -1.025776
O 4.939537 2.801414 -1.880860
N 2.269192 0.315067 1.463884
N 0.242832 0.944352 2.362653
N 1.471133 -0.583801 -0.712699
N -0.956925 -0.427106 -0.938052
C 4.251072 -1.145312 0.813171
C 3.732548 0.214566 1.344031
C 4.646782 -0.864500 -0.673505
C 5.001973 0.635593 -0.691036
C 4.608660 1.379128 -1.968912
C 1.301045 -0.008036 0.513308
C 1.569653 0.892170 2.545609
C 0.049296 0.383311 1.086955
C -1.108707 0.149151 0.296038
C 0.289158 -0.742805 -1.337426
C -3.806451 0.043180 -0.624952
C -5.249342 0.389320 -0.357911
C -5.771352 1.651480 -0.743497
C -6.109063 -0.543316 0.278748
C -7.125071 1.973348 -0.502072
C -7.463222 -0.223465 0.521068
C -7.974726 1.036277 0.131185
H 3.490374 -1.943075 0.904217
H 4.151424 0.389878 2.350382
H 3.795956 -1.090611 -1.338233
H 6.079152 0.771572 -0.477860
H 3.525954 1.225637 -2.163882
H 5.192891 0.991895 -2.820995
H 6.116899 -1.807263 0.919549
H 5.603120 -2.433429 -1.553791
H 2.091625 1.249960 3.431149
H 4.499778 3.160961 -1.067666
H -3.630890 -1.036764 -0.738500
H -3.384940 0.565997 -1.496044
H -5.114470 2.379970 -1.233831
H -5.714724 -1.520635 0.582359
H -7.516674 2.949841 -0.807606
H -8.117381 -0.953623 1.010140
H -9.025398 1.284863 0.317723


