%chk=000275436.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275436

0 1
S 3.626741 -1.854438 -0.959181
F 4.801855 -1.649335 -1.997166
O 4.224182 -2.625183 0.086420
O 2.557662 -2.351810 -1.784909
N -2.180457 -0.517000 -0.090288
N -3.597493 -2.158596 1.161338
N -1.536093 -2.847818 0.034505
N -0.019544 -1.296029 -0.875157
N -2.904438 -4.417567 1.174197
C -3.547318 -0.809963 0.591175
C -1.766227 0.861975 -0.227672
C -3.763384 0.197214 1.727729
C -4.618210 -0.677606 -0.504378
C -0.487522 2.768664 0.554920
C 0.489511 3.379627 1.525804
C -0.841815 1.418801 0.672531
C -1.276533 -1.578233 -0.306917
C 1.882681 3.578653 0.900554
C -2.317135 1.638149 -1.260210
C -1.047283 3.550127 -0.468784
C -2.712437 -3.078242 0.807059
C 2.435256 2.267540 0.415157
C -1.952277 2.982223 -1.368448
C 3.081052 1.392835 1.304014
C 2.263950 1.892924 -0.930118
C 3.277990 -0.256145 -0.459732
C 3.498209 0.135392 0.866090
C 2.679225 0.636125 -1.360656
H -4.678621 -0.063628 2.280388
H -2.944222 0.170342 2.455564
H -3.870370 1.223295 1.365231
H -5.590134 -1.011482 -0.112899
H -4.731261 0.351219 -0.854015
H -4.394059 -1.313656 -1.368907
H 0.105138 4.358090 1.883440
H 0.577906 2.750643 2.436660
H -0.406287 0.795439 1.453324
H 2.560997 4.039699 1.648219
H 1.819764 4.312764 0.070208
H -3.023557 1.196227 -1.961780
H -0.779538 4.600316 -0.560558
H -2.381022 3.593061 -2.163400
H 0.520970 -2.116809 -1.190990
H 0.029979 -0.526464 -1.530210
H 3.240084 1.685733 2.340932
H 1.778300 2.576222 -1.626777
H 3.985842 -0.552173 1.568519
H 2.520465 0.344499 -2.403972
H -3.559696 -4.594240 1.923206
H -2.089626 -5.016381 1.162640


%chk=000275436-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275436

0 1
S 3.623752 -2.021870 -1.063539
F 4.919000 -1.632922 -2.354048
O 4.310572 -2.894782 0.098169
O 2.360868 -2.578827 -1.900890
N -2.221555 -0.435106 0.022852
N -3.530291 -2.073455 1.342455
N -1.584886 -2.757372 0.015381
N -0.274028 -1.189695 -1.114477
N -2.553727 -4.195627 1.573967
C -3.620344 -0.837590 0.548018
C -1.822546 0.940525 -0.119766
C -4.166631 0.274979 1.462733
C -4.559466 -1.074413 -0.668893
C -0.455797 2.838406 0.682955
C 0.601778 3.397570 1.625221
C -0.859883 1.485101 0.771382
C -1.378346 -1.485219 -0.347475
C 2.009157 3.568363 0.949449
C -2.385945 1.771071 -1.122720
C -1.042739 3.659113 -0.316530
C -2.600866 -2.949721 0.975171
C 2.544688 2.248289 0.426771
C -1.999154 3.127697 -1.210176
C 3.124695 1.303611 1.313657
C 2.396468 1.903592 -0.943683
C 3.291251 -0.278659 -0.485632
C 3.508927 0.020787 0.868240
C 2.768449 0.630046 -1.420630
H -5.123512 -0.079109 1.879487
H -3.475121 0.454987 2.303033
H -4.337419 1.220085 0.919905
H -5.533547 -1.443117 -0.303301
H -4.727910 -0.143449 -1.240990
H -4.130528 -1.839565 -1.340142
H 0.291256 4.390287 2.003976
H 0.710685 2.735471 2.504215
H -0.438521 0.831787 1.544455
H 2.699558 3.997642 1.700111
H 1.923462 4.299347 0.124808
H -3.117036 1.353208 -1.822014
H -0.758757 4.716632 -0.387635
H -2.446623 3.769866 -1.977057
H 0.385209 -1.938724 -1.339167
H -0.150170 -0.266787 -1.522612
H 3.265729 1.564596 2.368705
H 1.970230 2.632833 -1.640962
H 3.942072 -0.719829 1.547876
H 2.647989 0.358668 -2.473712
H -3.260673 -4.445635 2.258762
H -1.798574 -4.828084 1.326997


