%chk=000187723.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187723

0 1
S 0.590888 -0.123348 1.739969
O 2.878988 2.378382 -0.325798
O -0.523576 -0.867618 2.304221
O 1.610544 0.372699 2.648365
N -0.035409 1.269256 0.923091
C 1.475451 2.796115 -0.254205
C -1.511705 1.398989 0.678541
C 0.769524 2.503838 1.061706
C 2.583565 3.811105 -0.303065
C -1.917085 0.160398 -0.136704
C -1.837463 2.657672 -0.154868
C -2.264888 1.511431 2.016628
C 1.323537 -1.039176 0.477369
C -1.509072 0.056622 -1.477375
C -2.687525 -0.871814 0.415734
C 2.557974 -0.642316 -0.047123
C 0.683547 -2.182436 -0.014246
C -1.892031 -1.037165 -2.256806
C -3.073698 -1.966497 -0.364974
C -2.683731 -2.049000 -1.703861
C 3.157749 -1.395935 -1.061388
C 1.283401 -2.936246 -1.026475
C 2.521160 -2.542076 -1.548021
H 0.913452 2.551609 -1.162002
H 0.144978 3.379294 1.350358
H 1.531792 2.394586 1.881611
H 2.824072 4.330674 -1.227263
H 2.920577 4.319330 0.597474
H -1.697431 3.579631 0.418501
H -1.221447 2.728898 -1.057676
H -2.885785 2.633642 -0.478876
H -1.911724 2.359696 2.610382
H -2.132577 0.609777 2.641262
H -3.340676 1.640623 1.862454
H -0.877529 0.830359 -1.913132
H -2.963296 -0.848220 1.473486
H 3.060335 0.260777 0.328500
H -0.289464 -2.485971 0.392380
H -1.571561 -1.102286 -3.294509
H -3.677066 -2.757009 0.078004
H -2.990082 -2.897290 -2.312201
H 4.118443 -1.085821 -1.469513
H 0.787257 -3.826420 -1.408037
H 2.989986 -3.130560 -2.337115


%chk=000187723-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187723

0 1
S 0.721480 -0.108604 1.671386
O 2.649931 2.692956 -0.517796
O -0.408045 -0.986238 2.463278
O 1.972676 0.511177 2.528873
N 0.000533 1.432116 0.628931
C 1.393284 3.363847 -0.011651
C -1.519634 1.417185 0.571949
C 0.673391 2.659514 1.127916
C 2.727331 4.012098 0.213215
C -1.956330 0.134883 -0.175937
C -1.918411 2.630858 -0.331030
C -2.189384 1.589732 1.961258
C 1.436997 -1.190691 0.306129
C -1.331458 -0.184651 -1.410398
C -3.008399 -0.694464 0.282485
C 2.437427 -0.646071 -0.516063
C 0.965359 -2.508554 0.220908
C -1.749265 -1.297597 -2.168828
C -3.430979 -1.809991 -0.476330
C -2.806620 -2.115334 -1.706424
C 2.992734 -1.498103 -1.499072
C 1.540967 -3.341663 -0.766216
C 2.548799 -2.837381 -1.621260
H 0.764843 3.739186 -0.829106
H -0.022829 3.363556 1.626986
H 1.428277 2.354521 1.885288
H 3.030441 4.864267 -0.406815
H 3.186493 3.952700 1.208137
H -1.690589 3.596294 0.154700
H -1.408743 2.585388 -1.307850
H -3.006634 2.585117 -0.511635
H -1.794971 2.489293 2.467492
H -2.002499 0.715099 2.605171
H -3.279459 1.731626 1.851854
H -0.495793 0.431916 -1.759260
H -3.492407 -0.491439 1.242072
H 2.761951 0.395100 -0.408571
H 0.176503 -2.858533 0.894206
H -1.247127 -1.529949 -3.114747
H -4.243600 -2.442878 -0.101754
H -3.135950 -2.979939 -2.293941
H 3.771918 -1.112072 -2.164679
H 1.199581 -4.377375 -0.864485
H 2.990608 -3.488703 -2.383583


