%chk=000240901.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240901

0 1
S 0.532886 -1.879985 -1.260071
O 2.137016 2.044896 1.267962
N -0.774589 0.450493 -1.109654
N 1.367511 0.334850 -0.056833
C -0.222855 2.107375 0.672949
C -0.889034 1.875384 -0.692892
C 1.204194 1.559102 0.677513
C -1.984562 -0.164270 -1.724377
C 0.329810 -0.292299 -0.789363
C -0.218560 3.589580 1.029198
C 2.663430 -0.352339 -0.013616
C -3.066475 -0.383012 -0.694364
C 3.002543 -1.103778 1.120105
C 3.542755 -0.211369 -1.096673
C -2.934572 -1.410187 0.251274
C -4.207090 0.432322 -0.686499
C 4.253085 -1.726564 1.160625
C 4.786791 -0.844681 -1.035092
C -3.937693 -1.615280 1.201764
C -5.209176 0.220333 0.265107
C 5.142749 -1.598255 0.088772
C -5.075132 -0.800806 1.210956
H -0.788586 1.542001 1.464646
H -1.961271 2.172861 -0.641166
H -0.411763 2.509444 -1.477489
H -1.716403 -1.138618 -2.214999
H -2.326722 0.499502 -2.551360
H 0.263023 4.202804 0.256595
H -1.233434 3.972999 1.183089
H 0.347954 3.766760 1.958278
H 2.304575 -1.207000 1.948147
H 3.259273 0.368916 -1.972064
H -2.049681 -2.052166 0.239701
H -4.324080 1.223726 -1.423649
H 4.532291 -2.316943 2.032302
H 5.480621 -0.750822 -1.869380
H -3.833883 -2.414887 1.934522
H -6.096954 0.850703 0.267371
H 6.113724 -2.088411 0.127879
H -5.856518 -0.964580 1.951084


%chk=000240901-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240901

0 1
S 0.526050 -2.103109 -1.132286
O 2.231165 1.884369 1.458204
N -0.764983 0.301433 -0.882652
N 1.436320 0.226961 0.003423
C -0.160609 1.936239 0.878559
C -0.823250 1.727222 -0.492045
C 1.267419 1.382991 0.825068
C -1.948891 -0.244581 -1.590147
C 0.365405 -0.455135 -0.664422
C -0.174290 3.410940 1.319938
C 2.776474 -0.357473 -0.057697
C -3.178283 -0.337742 -0.694983
C 3.326766 -0.986314 1.077695
C 3.516560 -0.246440 -1.253577
C -3.122198 -1.078668 0.514747
C -4.393790 0.288824 -1.063219
C 4.631322 -1.521087 1.009634
C 4.819028 -0.786567 -1.318175
C -4.263805 -1.189100 1.337250
C -5.539700 0.176486 -0.241323
C 5.378549 -1.425415 -0.187211
C -5.476406 -0.561180 0.962295
H -0.718504 1.326389 1.620517
H -1.885507 2.020898 -0.444124
H -0.325434 2.357448 -1.259618
H -1.652201 -1.243638 -1.960617
H -2.156912 0.402633 -2.464736
H 0.303891 4.056108 0.560810
H -1.211217 3.758251 1.475687
H 0.389215 3.533663 2.258427
H 2.741351 -1.056300 1.999515
H 3.070564 0.245838 -2.124037
H -2.186462 -1.576730 0.795565
H -4.447918 0.861097 -1.998277
H 5.062319 -2.012919 1.888335
H 5.394146 -0.708702 -2.247201
H -4.213159 -1.769221 2.265558
H -6.475329 0.663715 -0.537804
H 6.389755 -1.844080 -0.237873
H -6.362252 -0.649305 1.601096


