%chk=000201337.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201337

0 1
S 0.208731 -2.417043 0.160087
O 1.163456 1.200155 -1.480522
O 1.187316 -1.848901 1.069088
O -1.069625 -2.863591 0.686754
N -3.840915 1.130424 1.009320
C -0.087123 -1.279575 -1.157624
C -0.707337 -0.025356 -0.636123
C -0.036844 1.209176 -0.774314
C -1.960510 -0.045087 -0.019709
C -0.604168 2.403160 -0.311356
C -2.534304 1.151117 0.457567
C 2.324317 1.719824 -0.768444
C 0.957847 -3.778293 -0.658523
C -1.850216 2.378076 0.308282
C 2.842409 0.684280 0.226028
C 3.991456 1.244860 1.055481
H 0.854785 -1.010001 -1.698788
H -0.739715 -1.706969 -1.947575
H -2.486523 -0.995963 0.108597
H -0.071581 3.343302 -0.443809
H 2.072075 2.679171 -0.290105
H 3.020150 1.892230 -1.609674
H 1.287027 -4.550852 0.055224
H 0.283488 -4.301316 -1.347315
H 1.859113 -3.516455 -1.224267
H 2.018711 0.335039 0.892114
H 3.161233 -0.232591 -0.305815
H -2.298111 3.302561 0.663295
H 3.680401 2.113982 1.646461
H 4.357202 0.490223 1.764391
H 4.839176 1.547790 0.431926
H -4.062968 1.886696 1.641277
H -4.145553 0.237827 1.376771


%chk=000201337-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201337

0 1
S 0.163037 -2.757136 0.001886
O 1.136883 0.346509 -1.150448
O 0.679612 -1.936101 1.321559
O -0.725166 -4.124259 0.182220
N -3.928458 1.625447 1.036067
C -0.878410 -1.529167 -1.291611
C -1.139305 -0.224349 -0.660942
C -0.092536 0.742563 -0.586430
C -2.407922 0.077664 -0.109210
C -0.345350 1.998448 0.006533
C -2.670783 1.333230 0.498388
C 2.356253 1.103122 -0.789899
C 1.732151 -3.230480 -0.995135
C -1.617302 2.291218 0.538123
C 2.789294 0.868671 0.667609
C 4.149740 1.539690 0.956977
H -0.173906 -1.494330 -2.134918
H -1.756791 -2.164390 -1.475520
H -3.198832 -0.681192 -0.156710
H 0.438701 2.758804 0.068548
H 2.214025 2.181861 -1.007515
H 3.116728 0.714736 -1.490180
H 2.320079 -3.863538 -0.316140
H 1.397190 -3.784077 -1.883658
H 2.238891 -2.287150 -1.239866
H 2.019239 1.256993 1.358464
H 2.838529 -0.219635 0.853540
H -1.792870 3.270628 0.999590
H 4.107014 2.634277 0.797259
H 4.452911 1.365997 2.004408
H 4.947668 1.135078 0.305503
H -4.099922 2.509835 1.504083
H -4.656993 0.918935 1.066125


