%chk=000212295.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212295

0 1
S -1.920896 3.088914 -0.010297
O 2.448650 -1.786766 -0.130185
O 5.281888 -1.810265 0.006698
N -1.993017 0.490684 0.036340
N 0.266297 1.528586 0.114690
C 2.448427 0.525945 0.134372
C 3.211038 -0.659536 0.036120
C 4.632148 -0.589614 0.114016
C -4.417276 -0.037082 -0.048848
C -3.328343 0.951838 -0.026289
C 3.114512 1.756858 0.307810
C 5.266146 0.637870 0.285672
C 4.499894 1.810401 0.382102
C 0.981438 0.436135 0.053082
C -5.604367 0.242056 -0.747665
C -4.279779 -1.260531 0.628956
C -1.129380 1.497943 0.047539
C -3.466137 2.319606 -0.056174
C -6.644495 -0.690350 -0.756717
C -5.325006 -2.186870 0.615891
C -6.508277 -1.903408 -0.073994
C 3.114510 -3.071109 -0.249137
C 6.728466 -1.800537 0.075089
H 2.517010 2.671020 0.382630
H 6.349743 0.705566 0.346838
H 5.003506 2.766650 0.516237
H 0.574617 -0.590240 -0.061265
H -5.711596 1.179769 -1.290293
H -3.351465 -1.483422 1.158400
H -4.380295 2.885864 -0.090813
H -7.562600 -0.471690 -1.299135
H -5.215955 -3.132893 1.143551
H -7.321002 -2.627078 -0.081881
H 3.766443 -3.074787 -1.129199
H 2.262052 -3.749929 -0.370367
H 3.679758 -3.285552 0.664129
H 7.062388 -1.425973 1.047010
H 7.146161 -1.221249 -0.753410
H 6.961093 -2.867622 -0.035400


%chk=000212295-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212295

0 1
S -1.943110 3.295894 -0.084973
O 2.414477 -1.816187 0.430845
O 5.236659 -1.873566 0.435992
N -1.925464 0.623248 -0.022746
N 0.298029 1.682829 0.008948
C 2.450739 0.577502 0.124929
C 3.169344 -0.652862 0.241104
C 4.599993 -0.632253 0.259312
C -4.327181 -0.031004 -0.069653
C -3.272463 1.008276 -0.065358
C 3.166660 1.806640 0.018454
C 5.287626 0.595273 0.133263
C 4.567108 1.811183 0.014233
C 0.988626 0.558221 0.113522
C -5.709113 0.301719 -0.100587
C -3.957749 -1.403578 -0.041092
C -1.082778 1.653725 -0.022945
C -3.476559 2.392457 -0.100635
C -6.692141 -0.708855 -0.103656
C -4.942696 -2.413212 -0.044387
C -6.315148 -2.072658 -0.075822
C 2.709226 -3.009325 -0.393539
C 6.698106 -1.875536 0.546989
H 2.582483 2.727306 -0.064621
H 6.381363 0.617501 0.144526
H 5.116952 2.753710 -0.074696
H 0.495430 -0.423206 0.196704
H -6.024593 1.351029 -0.121278
H -2.892773 -1.653323 -0.015325
H -4.419546 2.932892 -0.135486
H -7.752704 -0.434003 -0.127314
H -4.640068 -3.466231 -0.021487
H -7.080480 -2.856691 -0.077921
H 2.628076 -2.759330 -1.468510
H 1.929732 -3.735186 -0.117332
H 3.712460 -3.402849 -0.169307
H 7.033693 -1.261210 1.404402
H 7.174518 -1.511191 -0.383724
H 6.969563 -2.927949 0.715274


