%chk=000195831.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195831

0 1
S 1.083199 -4.236293 0.038043
O -0.175818 -0.200147 -1.462643
O 3.111843 -0.373649 1.606854
O -4.427667 0.624875 1.608800
O -4.401140 2.527699 0.425339
O 3.539949 1.790242 -2.195286
O 4.926442 3.012616 -0.930667
N 0.137105 -1.403493 0.439152
N 2.207194 0.750885 -0.157565
N -5.276986 0.877127 -1.791521
C 1.570020 -1.616647 0.150669
C 2.096913 -2.905591 0.805887
C -2.148752 -0.708943 -0.140367
C -2.921055 0.119442 -1.169735
C -0.674987 -0.733030 -0.480160
C -4.387247 0.331137 -0.740915
C 2.380636 -0.379817 0.630747
C 1.978200 -2.972896 2.311606
C -4.420714 1.324248 0.419261
C 2.971093 1.973293 0.119194
C 3.936871 2.326086 -0.995273
H 1.707443 -1.695403 -0.974139
H 3.166938 -3.041069 0.504932
H -2.310493 -0.299925 0.883541
H -2.546887 -1.746740 -0.105440
H -2.410234 1.093279 -1.336841
H -2.883068 -0.386201 -2.157429
H -0.234644 -1.859732 1.269082
H -4.832156 -0.646327 -0.395441
H 0.944817 -2.970309 2.675034
H 2.484796 -2.100310 2.775076
H 2.468777 -3.862287 2.726351
H 1.615492 0.751090 -1.003611
H 1.567820 -5.295314 0.722926
H -5.295783 0.269987 -2.605656
H -4.978492 1.803299 -2.093983
H 3.554978 1.860027 1.077417
H 2.276973 2.837993 0.272589
H -4.479345 1.218688 2.404980
H 4.161069 2.017810 -2.940805


%chk=000195831-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195831

0 1
S 1.165854 -4.313203 0.473264
O -0.101850 -0.209397 -1.626906
O 3.374174 -0.248908 1.383550
O -5.026813 -0.942474 0.882607
O -5.374928 1.321212 1.257186
O 4.268929 0.862242 -2.254258
O 4.563643 3.143055 -1.919888
N 0.149042 -1.310840 0.398656
N 2.250234 0.694318 -0.430866
N -4.905259 1.815538 -1.443298
C 1.596569 -1.577686 0.239004
C 2.042919 -2.741679 1.152481
C -2.133024 -0.728111 -0.340608
C -2.772824 0.621410 -0.740980
C -0.624292 -0.723032 -0.576277
C -4.337423 0.594035 -0.867165
C 2.488916 -0.313413 0.474626
C 1.766364 -2.551710 2.653588
C -4.970310 0.405130 0.508381
C 3.042936 1.914369 -0.427241
C 4.020891 2.066011 -1.592624
H 1.754082 -1.867352 -0.820272
H 3.123027 -2.883497 0.991641
H -2.370653 -0.994622 0.704930
H -2.563665 -1.532463 -0.970989
H -2.480707 1.420912 -0.032766
H -2.371930 0.902768 -1.732931
H -0.308193 -1.700506 1.225648
H -4.609022 -0.284427 -1.483970
H 0.685411 -2.505292 2.884343
H 2.259069 -1.627802 3.001148
H 2.177437 -3.400013 3.228761
H 1.517090 0.530732 -1.148223
H 1.815353 -5.196928 1.319234
H -4.460868 2.137043 -2.304800
H -5.102942 2.553057 -0.761489
H 3.638698 1.924019 0.506369
H 2.405043 2.816274 -0.425292
H -5.437717 -1.014493 1.787540
H 4.929839 1.021425 -2.982109


