%chk=000276777.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276777

0 1
S 4.037353 -0.505287 -0.165463
O 4.471392 -0.450654 -1.549359
O 4.799145 0.149575 0.881405
N -1.608258 1.237855 0.198861
N 4.035939 -2.174115 0.255321
N -1.946053 -2.402931 -1.126732
N -4.616935 -0.409632 1.618305
C -0.293066 0.753204 0.086115
C 2.393261 -0.032052 -0.067530
C -2.615702 1.034884 -0.847528
C 0.249060 0.327865 -1.147864
C 0.521529 0.778150 1.247095
C 1.584019 -0.058874 -1.210475
C 1.852494 0.391926 1.155201
C -3.433302 -0.291032 -0.712535
C -2.596381 -1.470192 -0.932806
C -4.091705 -0.367006 0.591987
H -3.330481 1.893663 -0.810496
H -2.138812 1.060845 -1.858054
H -1.982358 1.366940 1.139360
H -0.361500 0.302858 -2.046152
H 0.116723 1.104865 2.201536
H 2.007446 -0.381044 -2.170926
H 2.487729 0.426238 2.049268
H -4.239236 -0.281156 -1.514550
H 4.214043 -2.856155 -0.477655
H 4.528456 -2.455939 1.099370


%chk=000276777-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276777

0 1
S 4.215734 -0.482642 -0.216483
O 4.550329 -0.593340 -1.809360
O 5.065566 0.464603 0.800226
N -1.650250 0.986099 0.304041
N 4.331095 -2.159120 0.547276
N -2.443684 -2.403646 -1.633996
N -4.878017 -0.419593 1.539476
C -0.306129 0.612477 0.147413
C 2.405109 -0.064292 -0.060216
C -2.647885 1.070986 -0.739158
C 0.220587 0.122459 -1.082550
C 0.566478 0.751559 1.270330
C 1.583511 -0.212757 -1.188268
C 1.924507 0.411159 1.172998
C -3.647940 -0.165191 -0.817006
C -2.981477 -1.412661 -1.247798
C -4.336219 -0.338163 0.480913
H -3.282431 1.962019 -0.578390
H -2.169920 1.179935 -1.726630
H -1.935900 1.279436 1.238830
H -0.421855 -0.026888 -1.954560
H 0.172562 1.133935 2.219491
H 2.005554 -0.573280 -2.131864
H 2.601149 0.532011 2.024407
H -4.414445 0.086794 -1.579966
H 4.318082 -2.872941 -0.200486
H 5.200688 -2.176159 1.107029


