%chk=000211127.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211127

0 1
S -1.814713 -0.161713 -2.331395
P -1.949192 -0.051710 -0.444340
O -1.784042 1.407417 0.255054
O -3.251330 -0.648349 0.315900
O -0.792747 -0.953062 0.371969
O 5.367784 -1.426816 -0.104385
O 5.307472 0.727839 -0.107254
N 4.760603 -0.364865 -0.067071
C -2.460397 2.575234 -0.357552
C -3.598199 -2.076358 0.103647
C 0.547335 -0.701174 0.209101
C -3.966708 2.420504 -0.241261
C -1.898397 3.703972 0.493486
C -4.182922 -2.455429 1.455020
C -4.599711 -2.134684 -1.035759
C 2.492741 0.734227 0.097335
C 1.099772 0.580640 0.192547
C 3.301171 -0.427177 0.033236
C 1.344643 -1.866367 0.152261
C 2.715077 -1.716876 0.065250
C 3.073562 2.099970 0.072578
H -2.121750 2.654583 -1.417652
H -2.675314 -2.660479 -0.114443
H -4.473023 3.393905 -0.266557
H -4.401292 1.820841 -1.052023
H -4.253486 1.940970 0.708461
H -2.284888 4.678682 0.175495
H -0.802659 3.738012 0.436837
H -2.152929 3.567519 1.554593
H -4.523637 -3.496191 1.471160
H -3.441621 -2.325351 2.256192
H -5.036666 -1.814442 1.715074
H -5.138628 -3.089544 -1.048804
H -4.125030 -2.017497 -2.021300
H -5.350547 -1.337031 -0.949164
H 0.465507 1.468573 0.275962
H 0.869923 -2.845859 0.174811
H 3.370784 -2.597134 0.014954
H 2.325552 2.898875 0.138386
H 3.798454 2.248634 0.894898
H 3.665050 2.269610 -0.847447


%chk=000211127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211127

0 1
S -1.715637 0.051794 -2.385149
P -1.941864 0.017029 -0.335917
O -1.915364 1.511048 0.506921
O -3.309084 -0.757919 0.337508
O -0.715709 -0.847000 0.589441
O 5.564531 -1.514084 0.579691
O 5.537105 0.593985 -0.270389
N 4.931308 -0.457862 0.178512
C -2.600959 2.721601 -0.094963
C -3.723186 -2.129079 -0.175412
C 0.670122 -0.678905 0.428604
C -4.122071 2.575383 0.028181
C -2.021088 3.898733 0.691283
C -4.078450 -2.926536 1.081011
C -4.884943 -1.940506 -1.156427
C 2.662808 0.651454 -0.167639
C 1.257677 0.510372 -0.054449
C 3.452905 -0.467901 0.241113
C 1.470235 -1.776082 0.826605
C 2.861817 -1.659949 0.734054
C 3.206028 1.963329 -0.698299
H -2.297959 2.768421 -1.160945
H -2.851657 -2.580095 -0.689938
H -4.615509 3.481954 -0.367662
H -4.492567 1.705365 -0.541578
H -4.411523 2.447004 1.085248
H -2.435239 4.846486 0.302188
H -0.922308 3.931495 0.599807
H -2.281051 3.814212 1.760396
H -4.392504 -3.948698 0.800023
H -3.211410 -2.993595 1.758651
H -4.910176 -2.441141 1.620378
H -5.243412 -2.926378 -1.506207
H -4.568177 -1.354780 -2.036204
H -5.723758 -1.421438 -0.660356
H 0.618831 1.351988 -0.336897
H 0.992240 -2.685879 1.198279
H 3.519065 -2.480581 1.031037
H 2.374499 2.651396 -0.925724
H 3.886003 2.444877 0.025011
H 3.806033 1.812383 -1.611988


