%chk=000282735.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282735

0 1
S -2.611064 1.553837 -1.541883
O 0.736133 1.205404 0.601791
O 2.005346 1.358129 -2.484693
O 3.726163 -0.490835 -0.347929
O 3.095634 2.850947 1.470274
N -0.569414 -0.169641 -0.779329
N -2.686763 -1.095575 -0.860459
N 0.681079 -2.226444 -0.047310
N -0.772956 -4.182549 0.194370
N -3.105142 -4.110337 -0.187948
C 1.809598 0.432656 -1.414825
C 0.466533 0.879984 -0.772102
C 2.871130 0.649462 -0.306685
C 2.045469 0.686672 1.001740
C 2.551656 1.666324 2.061207
C -0.436659 -1.514211 -0.404351
C -1.976543 0.020972 -1.023377
C -1.762317 -2.078561 -0.475828
C -1.898970 -3.465040 -0.159999
C 0.433972 -3.534771 0.231178
C -3.170375 2.286327 0.030431
C -1.999217 2.888701 0.723925
C -1.828840 4.201887 0.869694
H 1.824369 -0.616256 -1.788411
H 0.064344 1.823588 -1.231496
H 3.462503 1.579371 -0.466062
H 1.887093 -0.339596 1.407683
H 3.407009 1.249713 2.627139
H 1.737830 1.942513 2.759598
H 2.699381 1.025884 -3.096300
H 4.530618 -0.329822 0.189778
H 2.384317 3.338492 0.993470
H 1.302014 -4.153256 0.520948
H -3.950064 3.030656 -0.237533
H -3.674250 1.524648 0.660814
H -3.939783 -3.617903 -0.468511
H -3.168474 -5.094886 0.019496
H -1.268759 2.169049 1.116547
H -0.975634 4.631389 1.375582
H -2.516669 4.948079 0.499465


%chk=000282735-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282735

0 1
S -2.385314 1.680083 -1.796228
O 0.903757 1.122740 0.618311
O 2.034492 0.827505 -2.753806
O 4.199302 -0.048601 -0.585430
O 2.799681 2.951851 1.671027
N -0.490455 -0.200415 -0.837176
N -2.647416 -0.992268 -0.991043
N 0.606135 -2.244617 0.079966
N -0.990581 -4.095123 0.373015
N -3.284696 -3.905857 -0.163352
C 1.935724 0.267608 -1.410606
C 0.606999 0.765062 -0.792192
C 3.003979 0.778720 -0.426971
C 2.291986 0.642909 0.937231
C 2.802016 1.539995 2.064377
C -0.459111 -1.527143 -0.385660
C -1.845533 0.071892 -1.176248
C -1.796137 -1.993052 -0.493841
C -2.041277 -3.340692 -0.096116
C 0.246941 -3.515725 0.435260
C -3.221202 2.334481 -0.169534
C -2.214806 2.883596 0.797782
C -2.171198 4.183894 1.188713
H 1.989387 -0.837765 -1.418967
H 0.256323 1.673074 -1.311315
H 3.215770 1.850122 -0.624701
H 2.258034 -0.421622 1.242041
H 3.850552 1.291735 2.304720
H 2.186140 1.377883 2.972800
H 2.832816 0.440591 -3.193097
H 4.976349 0.412688 -0.182880
H 1.884426 3.151060 1.339751
H 1.049638 -4.153290 0.817542
H -3.937006 3.095158 -0.522034
H -3.769387 1.460343 0.218311
H -4.070214 -3.364613 -0.518547
H -3.404374 -4.872681 0.131994
H -1.483138 2.168935 1.201661
H -1.428132 4.538744 1.911325
H -2.880172 4.927796 0.804017


