%chk=000295698.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295698

0 1
S -1.128449 -3.941655 -1.065560
O -0.288132 0.939649 -0.082278
O 3.771501 0.323244 -0.846039
O 2.351612 1.777109 0.148515
N -0.668962 -1.340146 -0.551274
N 1.235843 -2.773173 -1.039880
C 1.596864 -0.422351 -0.541342
C 0.191775 -0.283698 -0.393383
C -1.689892 1.152865 0.059372
C 2.531799 0.691780 -0.347798
C 2.063126 -1.717564 -0.880628
C 4.869733 1.278959 -0.704776
C -2.052206 1.750059 1.270182
C -2.582502 0.916566 -0.986648
C -0.107853 -2.541163 -0.861062
C -3.386375 2.134813 1.426169
C -3.911916 1.308583 -0.799265
C -4.311345 1.913729 0.398030
C 5.403149 1.244161 0.711998
C -2.784389 -3.325867 -0.732884
H 3.142873 -1.897120 -1.024285
H 5.582711 0.884243 -1.451474
H 4.504583 2.279840 -0.997649
H -1.308588 1.915368 2.048464
H -2.254101 0.438237 -1.906965
H -3.705584 2.608204 2.354648
H -4.638504 1.143239 -1.594420
H -5.348847 2.216554 0.531024
H 6.319652 1.837507 0.810490
H 4.668199 1.652839 1.422404
H 5.629932 0.220089 1.034298
H -3.483797 -4.166217 -0.832386
H -3.080993 -2.531900 -1.432530
H -2.875517 -2.908282 0.280630


%chk=000295698-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295698

0 1
S -1.177408 -3.998629 -1.059388
O -0.311508 0.910190 0.009868
O 3.849633 0.296493 -0.847819
O 2.343107 1.809621 0.103172
N -0.644322 -1.364900 -0.512214
N 1.222180 -2.801050 -1.122992
C 1.610167 -0.435651 -0.570680
C 0.197828 -0.314256 -0.364102
C -1.724684 1.146536 0.098649
C 2.575147 0.679679 -0.385878
C 2.047346 -1.732750 -0.963886
C 4.938617 1.305288 -0.680561
C -2.178971 1.716079 1.302771
C -2.579075 0.952943 -1.006146
C -0.103357 -2.558545 -0.874676
C -3.539385 2.083971 1.411338
C -3.935854 1.325128 -0.882485
C -4.420401 1.886730 0.322979
C 5.568672 1.202613 0.711610
C -2.842087 -3.250019 -0.603091
H 3.109924 -1.900699 -1.153715
H 5.652983 1.047137 -1.478730
H 4.516368 2.310247 -0.856076
H -1.472621 1.870284 2.123523
H -2.195213 0.524919 -1.936077
H -3.905697 2.528142 2.342972
H -4.612078 1.183134 -1.732520
H -5.473333 2.175284 0.409221
H 6.428216 1.894993 0.782338
H 4.840764 1.478143 1.492843
H 5.933725 0.179198 0.905413
H -3.568312 -4.071941 -0.699971
H -3.084196 -2.427645 -1.290025
H -2.810776 -2.872166 0.428032


