%chk=000187286.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187286

0 1
S -6.419995 -0.156554 0.089055
N 5.862073 -0.089077 0.107579
N 0.215857 -0.188100 -0.231973
N -0.521134 -0.013649 0.772204
N -6.159496 0.071428 -1.615587
C 4.453161 -0.009192 0.032443
C -3.979941 0.020937 -0.715534
C 3.775973 -0.321091 -1.175740
C 3.682527 0.259431 1.194533
C -4.717524 -0.156050 0.480054
C 1.632275 -0.111578 -0.053223
C -1.949043 -0.082081 0.563190
C -2.582959 0.056857 -0.679818
C 2.390474 -0.375686 -1.214887
C 2.297764 0.202672 1.150775
C 6.630786 0.017434 -1.160747
C 6.536162 0.606003 1.236044
C -4.089818 -0.296310 1.717387
C -2.699899 -0.255580 1.755741
C -4.879829 0.143345 -1.872162
H 4.339515 -0.534612 -2.081439
H 4.173303 0.499198 2.135400
H -2.000314 0.188130 -1.592673
H 1.876492 -0.622024 -2.147255
H 1.711895 0.405546 2.051398
H 6.262288 -0.731193 -1.885357
H 6.571596 1.014274 -1.626370
H 7.691373 -0.218110 -0.971348
H 6.461232 1.703922 1.181628
H 7.603254 0.328416 1.256976
H 6.100691 0.271404 2.195097
H -4.668598 -0.432401 2.629610
H -2.169013 -0.357224 2.705196
H -4.498028 0.285416 -2.885199


%chk=000187286-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187286

0 1
S -6.504746 -0.163883 0.114741
N 5.857754 0.158627 0.041502
N 0.195349 -0.013160 -0.298486
N -0.507936 0.052783 0.811791
N -6.164873 -0.312972 -1.689554
C 4.466707 0.116839 -0.017170
C -3.971490 -0.167740 -0.703161
C 3.777959 0.012879 -1.271872
C 3.672674 0.175437 1.182158
C -4.743255 -0.082674 0.503723
C 1.599660 0.034505 -0.125666
C -1.924607 -0.000499 0.608490
C -2.560572 -0.126113 -0.651134
C 2.378536 -0.026958 -1.314724
C 2.277422 0.135975 1.127291
C 6.650763 0.102966 -1.195725
C 6.544709 0.258725 1.338356
C -4.114314 0.042702 1.762394
C -2.709481 0.081916 1.801195
C -4.839443 -0.292702 -1.863887
H 4.338889 -0.038001 -2.208503
H 4.160726 0.252656 2.157718
H -1.945717 -0.188540 -1.554162
H 1.850276 -0.106578 -2.270950
H 1.677010 0.181912 2.041274
H 6.479710 -0.841679 -1.749528
H 6.409736 0.946597 -1.872682
H 7.721660 0.162190 -0.947667
H 6.267327 1.185708 1.878634
H 7.633215 0.274958 1.174571
H 6.311302 -0.604100 1.993203
H -4.697045 0.107853 2.685956
H -2.175628 0.177691 2.752254
H -4.479179 -0.373420 -2.895382


