%chk=000190762.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190762

0 1
S 2.733045 -0.725138 1.029074
O 0.189597 2.131615 2.175441
N -0.001328 0.055050 0.262582
N -2.891227 -2.415302 0.669889
N -1.270276 1.596170 -1.170736
C -0.952742 -0.921987 0.879095
C 0.738754 -0.504015 -0.917741
C -2.165080 -1.293448 0.000758
C -0.619120 1.339768 -0.006814
C 1.904391 -1.269836 -0.412737
C -0.468995 2.339791 1.000039
C 2.510402 -2.381673 -0.912420
C -1.027665 3.611244 0.799302
C -3.983736 -2.950656 -0.189481
C 3.656664 -2.802376 -0.135246
C 3.905931 -2.011981 0.942274
C -1.793317 2.834567 -1.358592
C -1.699542 3.856684 -0.397299
H -1.291200 -0.492799 1.847252
H -0.371955 -1.843494 1.126011
H 1.092651 0.331723 -1.572855
H 0.089672 -1.138597 -1.568207
H -1.814974 -1.638130 -0.998508
H -2.799128 -0.401197 -0.189402
H -3.296957 -2.078574 1.551017
H 2.196577 -2.921689 -1.793974
H -0.919647 4.375247 1.568503
H -4.742305 -2.214040 -0.492712
H -4.487846 -3.767649 0.352796
H -3.550168 -3.391320 -1.102765
H 4.236131 -3.671655 -0.415929
H 4.685568 -2.102448 1.677005
H -2.304123 2.997373 -2.313476
H -2.143220 4.832257 -0.588722
H 0.673568 1.247015 2.164376


%chk=000190762-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190762

0 1
S 2.965646 -0.773654 0.954563
O -0.310829 1.961499 2.314381
N 0.009447 0.235717 0.162698
N -2.799343 -2.281127 0.788553
N -0.948220 1.894969 -1.329450
C -0.837297 -0.789968 0.850852
C 0.858487 -0.283529 -0.945229
C -1.953547 -1.396726 -0.035410
C -0.615599 1.502432 -0.071320
C 1.908048 -1.238865 -0.443808
C -0.799984 2.351433 1.065885
C 2.268841 -2.483787 -0.934962
C -1.439600 3.593420 0.900988
C -3.769260 -3.097119 0.034253
C 3.375879 -3.096830 -0.235607
C 3.865132 -2.321723 0.801591
C -1.532733 3.120207 -1.489059
C -1.826587 3.977890 -0.405585
H -1.302756 -0.316345 1.737026
H -0.184083 -1.601761 1.214453
H 1.315788 0.595464 -1.434200
H 0.261495 -0.792083 -1.730272
H -1.504609 -2.016016 -0.835788
H -2.518527 -0.574554 -0.539908
H -3.244485 -1.768007 1.561212
H 1.754155 -2.953368 -1.777874
H -1.586006 4.245702 1.766760
H -4.476532 -2.507991 -0.599439
H -4.363900 -3.708980 0.735557
H -3.224965 -3.790999 -0.633180
H 3.783305 -4.078219 -0.490322
H 4.673387 -2.535376 1.498836
H -1.773018 3.406116 -2.518737
H -2.321702 4.937731 -0.581860
H 0.312372 1.194949 2.152199


