%chk=000266974.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266974

0 1
S -4.916900 -0.938239 -0.103224
O 1.491187 -0.522937 1.685520
O -5.457044 -0.708429 -1.428235
O -5.372296 -2.044585 0.714411
N -5.214826 0.499166 0.805742
C 1.877482 -0.305792 0.309621
C 1.097851 -1.314719 -0.574383
C 1.640489 1.159427 -0.037766
C 3.364291 -0.645079 0.266886
C -0.394810 -1.207535 -0.462001
C -1.057539 -1.807761 0.623782
C -1.144691 -0.538219 -1.442488
C -3.186029 -1.040255 -0.237432
C 1.378469 1.579840 -1.347561
C 3.961591 -1.312307 1.344821
C 1.732224 2.113711 0.987418
C 4.133431 -0.307773 -0.855863
C -2.446545 -1.728406 0.728465
C -2.534442 -0.461169 -1.329192
C 1.187822 2.937276 -1.625417
C 5.319363 -1.640869 1.299128
C 1.540417 3.468442 0.708461
C 5.489899 -0.640730 -0.898291
C 1.264621 3.882844 -0.598968
C 6.084819 -1.307947 0.177615
C -4.820592 0.446549 2.231358
C -4.868765 1.767423 0.125656
H 1.418650 -2.340396 -0.276000
H 1.429000 -1.214491 -1.628179
H -0.483340 -2.352190 1.374952
H -0.648259 -0.080615 -2.296526
H 0.556244 -0.260152 1.826032
H 1.323071 0.855740 -2.159152
H 3.361061 -1.566740 2.222277
H 1.967066 1.788634 2.004028
H 3.683869 0.223239 -1.693247
H -2.957785 -2.220757 1.563760
H -3.114845 0.045423 -2.109075
H 0.982414 3.257480 -2.645603
H 5.779887 -2.156667 2.140174
H 1.612827 4.203032 1.509179
H 6.085220 -0.376518 -1.770607
H 1.116378 4.939101 -0.816906
H 7.141873 -1.565152 0.142236
H -5.207548 -0.488768 2.682911
H -5.300336 1.278236 2.778120
H -3.734895 0.509192 2.404380
H -5.300030 1.763104 -0.895093
H -3.787441 1.967016 0.060548
H -5.338660 2.613319 0.658827


%chk=000266974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266974

0 1
S -5.046843 -1.003901 -0.057830
O 1.437978 -0.347320 1.674008
O -5.651736 -0.645129 -1.523822
O -5.487233 -2.310080 0.804551
N -5.493617 0.481877 1.038002
C 1.920691 -0.195926 0.282805
C 1.148666 -1.239738 -0.623169
C 1.730100 1.268010 -0.169849
C 3.409671 -0.603500 0.318487
C -0.365951 -1.175361 -0.507395
C -1.021666 -1.877149 0.543827
C -1.156400 -0.437242 -1.429357
C -3.157457 -1.068358 -0.235094
C 1.624275 1.643926 -1.534037
C 3.866097 -1.503994 1.314121
C 1.716383 2.291893 0.812760
C 4.321397 -0.150762 -0.666593
C -2.426033 -1.829766 0.690983
C -2.561370 -0.378446 -1.304090
C 1.493596 3.000943 -1.905478
C 5.208619 -1.942093 1.321974
C 1.584522 3.648574 0.444513
C 5.662647 -0.595351 -0.662292
C 1.469594 4.010524 -0.917311
C 6.112390 -1.494222 0.330947
C -4.963927 0.300688 2.408146
C -5.133033 1.754312 0.372340
H 1.501905 -2.234780 -0.299267
H 1.470533 -1.113236 -1.671242
H -0.428215 -2.489196 1.231951
H -0.673100 0.090831 -2.257135
H 0.465355 -0.147801 1.683372
H 1.652536 0.884258 -2.323665
H 3.167721 -1.833641 2.088133
H 1.823030 2.011439 1.865321
H 3.998559 0.566942 -1.427602
H -2.943527 -2.395896 1.472502
H -3.181407 0.156099 -2.031172
H 1.413928 3.267633 -2.965432
H 5.549525 -2.631242 2.103018
H 1.578665 4.423154 1.219749
H 6.356356 -0.232756 -1.429240
H 1.368317 5.062985 -1.204365
H 7.153728 -1.835245 0.336876
H -5.186407 -0.725937 2.743551
H -5.510832 0.999761 3.066536
H -3.873012 0.504383 2.504035
H -5.472586 1.716179 -0.676004
H -4.046738 1.996541 0.411924
H -5.691798 2.560116 0.882111


