%chk=000207095.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207095

0 1
S 3.011429 1.502150 -0.779299
S 3.266711 -1.393401 -0.205533
N -1.707756 -0.171754 0.206399
N 1.156598 0.074645 0.495484
C -0.977838 1.012782 -0.352228
C -0.824960 -1.385528 0.164240
C 0.278883 1.280082 0.502047
C 0.438373 -1.131399 1.009238
C -2.989461 -0.428470 -0.533568
C -4.015123 0.656156 -0.205836
C 2.353721 -0.010539 -0.103952
H -1.651039 1.896619 -0.290312
H -0.696119 0.892288 -1.421001
H -0.536781 -1.685529 -0.867294
H -1.385427 -2.238476 0.607485
H 0.797913 2.194083 0.145395
H -0.016771 1.479988 1.561497
H 0.165717 -0.939838 2.073386
H 1.095624 -2.033297 0.999261
H -2.846859 -0.502562 -1.633617
H -3.383903 -1.413866 -0.195215
H -4.070271 0.830854 0.878121
H -3.772985 1.614460 -0.677275
H -5.014977 0.363084 -0.545126
H 4.217101 1.018967 -1.179497


%chk=000207095-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207095

0 1
S 3.108605 1.622062 -0.652961
S 3.440371 -1.405595 -0.063742
N -1.726118 -0.182431 0.190014
N 1.153255 0.045001 0.396978
C -1.013098 0.990177 -0.370325
C -0.855448 -1.384215 0.134141
C 0.289858 1.251964 0.412135
C 0.447100 -1.153082 0.920780
C -3.049170 -0.430416 -0.442536
C -4.072023 0.689108 -0.178943
C 2.447743 -0.014239 -0.041800
H -1.654121 1.884399 -0.282254
H -0.764985 0.849313 -1.453814
H -0.597132 -1.665911 -0.918001
H -1.394801 -2.235115 0.589614
H 0.820970 2.111973 -0.023556
H 0.041187 1.488288 1.464970
H 0.211415 -0.976593 1.988206
H 1.125352 -2.016698 0.834435
H -2.947973 -0.595134 -1.546632
H -3.436313 -1.375023 -0.014530
H -4.150204 0.888264 0.904321
H -3.805963 1.632657 -0.688373
H -5.067125 0.385141 -0.551198
H 4.340417 1.077604 -0.954130


