%chk=000225430.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225430

0 1
S -3.821099 1.502371 -1.473153
S 3.816363 1.479669 1.491345
S -0.136270 3.811478 -0.991608
S 0.135991 3.800128 1.033275
O -6.502542 -2.315307 0.145199
O 6.506076 -2.316851 -0.161211
O -2.579335 0.102803 0.387881
O 2.586299 0.107349 -0.397429
N -4.114529 -1.102840 -0.835806
N 4.111843 -1.116831 0.819980
C -5.362745 -1.099321 -1.641813
C -4.050878 -2.264629 0.100953
C 4.054181 -2.265131 -0.133650
C 5.354309 -1.125660 1.634784
C -6.590575 -1.162665 -0.716775
C -5.317750 -2.323060 0.968983
C 5.327158 -2.312086 -0.993407
C 6.588649 -1.176648 0.717685
C -3.437900 0.053345 -0.463229
C 3.438792 0.045097 0.458895
C -2.634694 2.728691 -0.820894
C 2.632337 2.714412 0.850811
C -1.264223 2.447495 -1.381126
C 1.261328 2.429800 1.407988
H -5.333776 -2.005205 -2.295368
H -5.422028 -0.229892 -2.329717
H -3.136422 -2.189935 0.734820
H -3.952387 -3.187744 -0.513494
H 3.950772 -3.196824 0.466880
H 3.144300 -2.180789 -0.772869
H 5.409175 -0.266189 2.335452
H 5.320167 -2.040760 2.275117
H -7.525512 -1.356733 -1.272960
H -6.698943 -0.253088 -0.100850
H -5.370127 -1.484147 1.684995
H -5.414068 -3.284460 1.505466
H 5.385111 -1.463115 -1.697028
H 5.426729 -3.265826 -1.542810
H 7.519499 -1.379241 1.277668
H 6.701913 -0.258473 0.115551
H -3.030041 3.722525 -1.118371
H -2.639253 2.690681 0.291982
H 3.029138 3.704677 1.158035
H 2.637079 2.687264 -0.262446
H -0.857990 1.482653 -1.000831
H -1.261856 2.365652 -2.490582
H 0.853140 1.469961 1.017469
H 1.258793 2.336100 2.516514


%chk=000225430-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225430

0 1
S -3.063895 1.510493 -1.670236
S 3.062534 1.493910 1.684445
S 0.139317 4.748288 -1.110508
S -0.139598 4.738103 1.157048
O -3.990684 -3.405334 0.113074
O 3.990158 -3.404685 -0.140308
O -1.668334 0.940351 0.645593
O 1.675904 0.949390 -0.643078
N -2.673655 -0.898933 -0.377056
N 2.672602 -0.901939 0.366355
C -3.468372 -1.539237 -1.446895
C -2.126743 -1.846607 0.625001
C 2.131616 -1.838483 -0.649302
C 3.458788 -1.554470 1.435131
C -4.567267 -2.420584 -0.816852
C -3.263867 -2.714376 1.193982
C 3.271888 -2.701588 -1.219170
C 4.561306 -2.430288 0.803772
C -2.362226 0.442076 -0.282338
C 2.364110 0.440539 0.283318
C -2.213276 3.132774 -1.170798
C 2.212566 3.121459 1.201528
C -0.755491 3.144880 -1.621142
C 0.754995 3.129735 1.652562
H -2.799898 -2.169505 -2.067203
H -3.924086 -0.774377 -2.096852
H -1.630284 -1.262513 1.417091
H -1.375696 -2.496219 0.130499
H 1.376352 -2.492377 -0.167031
H 1.641342 -1.245520 -1.438661
H 3.910259 -0.797219 2.096830
H 2.785056 -2.190784 2.043466
H -5.084476 -3.011805 -1.589826
H -5.302003 -1.780602 -0.282656
H -3.966879 -2.081699 1.776777
H -2.865325 -3.514357 1.838798
H 3.979832 -2.063579 -1.790058
H 2.877208 -3.494262 -1.875287
H 5.072519 -3.030095 1.574114
H 5.300344 -1.785591 0.281320
H -2.813324 3.925950 -1.645169
H -2.289230 3.207640 -0.073824
H 2.813178 3.909646 1.683424
H 2.288022 3.207071 0.105292
H -0.180732 2.298868 -1.214742
H -0.658001 3.151100 -2.722293
H 0.179747 2.287860 1.238404
H 0.657900 3.125592 2.753757


