%chk=000221325.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221325

0 1
S -0.349168 -2.680905 0.170291
O -0.904301 -3.708072 -0.680044
O -0.000151 -2.966527 1.530357
O 4.647689 0.834145 -0.869482
O -4.728001 2.201430 -0.891392
O -3.565572 3.113892 0.690918
N 1.082653 -2.227850 -0.723219
N 1.706945 -1.125706 -0.241784
N -3.822537 2.203244 -0.076312
C -1.346913 -1.261158 0.100003
C -2.408167 -1.216678 -0.809563
C -1.088382 -0.186172 0.953747
C -2.955803 0.988746 -0.013085
C -3.225225 -0.084535 -0.872113
C -1.897666 0.954708 0.901757
C 3.460557 0.466328 -0.195584
C 2.857756 -0.739747 -0.730015
C 3.191319 1.365481 0.808696
C 4.243384 2.350065 0.780624
C 5.092677 1.997305 -0.235032
H -2.607621 -2.069379 -1.473244
H -0.252896 -0.226714 1.665053
H -4.062613 -0.029520 -1.577266
H -1.710976 1.809361 1.562299
H 1.509539 -2.840874 -1.434438
H 3.439064 -1.236586 -1.522885
H 2.366255 1.348988 1.494373
H 4.320765 3.189968 1.444602
H 5.994789 2.382462 -0.655664


%chk=000221325-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221325

0 1
S -0.270193 -2.483237 0.222059
O -0.834033 -3.786187 -0.572237
O 0.280541 -2.548801 1.750661
O 5.193241 0.556465 -0.791400
O -5.338401 1.904617 -0.985797
O -4.451715 2.853329 0.889722
N 1.056639 -1.755643 -1.037258
N 1.816720 -0.779046 -0.452570
N -4.479948 1.945015 -0.024817
C -1.553859 -1.105694 0.134839
C -2.490451 -1.150304 -0.910548
C -1.528008 -0.120693 1.134945
C -3.449420 0.869184 0.032093
C -3.466718 -0.134508 -0.961742
C -2.504749 0.895364 1.081009
C 3.866696 0.468258 -0.293923
C 3.074984 -0.607511 -0.832170
C 3.660215 1.487424 0.639472
C 4.888695 2.231288 0.736260
C 5.792115 1.642738 -0.140233
H -2.465245 -1.960390 -1.645630
H -0.781012 -0.161216 1.933054
H -4.228275 -0.106448 -1.744810
H -2.545405 1.694798 1.824890
H 1.537892 -2.600468 -1.433327
H 3.566730 -1.242594 -1.592074
H 2.733471 1.663738 1.180146
H 5.082125 3.092607 1.372254
H 6.824768 1.843615 -0.411270


