%chk=000226631.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226631

0 1
S 1.050530 2.293879 0.160505
O 1.136810 3.431798 -0.739837
O 1.328605 2.496239 1.560538
O -4.097148 -2.088330 0.962501
N 2.294352 0.016468 0.131810
N 2.250484 1.222383 -0.522153
N -4.149544 -0.440942 -0.655550
C 4.389122 -2.986231 0.107469
C 5.336375 -1.987669 -0.587678
C 3.210245 -2.169406 0.665934
C 4.510733 -0.721862 -0.882878
C 3.259929 -0.834098 -0.042712
C -0.441835 1.483689 -0.058574
C -0.799479 0.413316 0.771655
C -1.312657 1.896093 -1.076596
C -2.889183 0.177634 -0.420792
C -2.016434 -0.242539 0.599084
C -2.533233 1.257717 -1.265479
C -4.692094 -1.547811 0.057333
C -6.051493 -1.960481 -0.428649
H 4.907447 -3.540550 0.906781
H 4.027526 -3.741409 -0.612626
H 5.761958 -2.414584 -1.510233
H 6.191017 -1.745320 0.068595
H 3.301002 -2.022092 1.760061
H 2.242194 -2.677975 0.503215
H 4.245655 -0.659781 -1.955903
H 5.080416 0.194037 -0.644052
H 3.094466 1.601348 -0.974262
H -0.118029 0.083379 1.566540
H -1.031241 2.733879 -1.728625
H -2.287046 -1.078853 1.253967
H -3.198954 1.591457 -2.056567
H -4.706934 -0.038401 -1.414058
H -6.801345 -1.165320 -0.316104
H -6.413026 -2.821102 0.162196
H -6.048390 -2.279658 -1.479756


%chk=000226631-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226631

0 1
S 1.040170 2.178668 0.306489
O 1.159071 3.499312 -0.640334
O 1.316118 2.241388 1.908131
O -4.709674 -1.785340 1.215138
N 2.422735 -0.199284 0.192435
N 2.236520 0.936581 -0.589746
N -4.343438 -0.446098 -0.680268
C 4.780145 -2.982034 -0.065744
C 5.644609 -1.837046 -0.666712
C 3.707172 -2.236971 0.771825
C 4.616663 -0.721984 -1.003400
C 3.484970 -0.943837 -0.000286
C -0.605832 1.345201 0.019565
C -1.107466 0.484927 1.008254
C -1.290437 1.632192 -1.172953
C -3.079184 0.134148 -0.398171
C -2.358856 -0.130251 0.800506
C -2.539652 1.020208 -1.374849
C -5.091685 -1.346451 0.094224
C -6.418511 -1.747983 -0.548383
H 5.374877 -3.690876 0.535577
H 4.295076 -3.555124 -0.878733
H 6.226114 -2.156907 -1.548325
H 6.361593 -1.470304 0.091901
H 4.100653 -2.000825 1.781425
H 2.769703 -2.800088 0.912096
H 4.220867 -0.832060 -2.034097
H 5.050290 0.297255 -0.941119
H 3.079976 1.514870 -0.816527
H -0.538311 0.308763 1.925936
H -0.863867 2.324884 -1.904838
H -2.783191 -0.807465 1.542904
H -3.100125 1.229886 -2.294445
H -4.763388 -0.168024 -1.570946
H -7.072720 -0.869655 -0.701349
H -6.929849 -2.456189 0.118665
H -6.260335 -2.234585 -1.528749


