%chk=000277907.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277907

0 1
S -1.282105 1.852753 -1.110322
O -1.783638 2.138768 -2.443877
O -1.035182 2.953902 -0.212605
N 0.868620 0.623064 -0.342574
N 0.222011 1.044110 -1.476509
C 4.275787 -2.151976 0.516800
C 4.490569 -1.845004 -0.970122
C 2.873770 -1.782600 1.014745
C 4.438112 -0.345397 -1.292332
C 2.608434 -0.270404 1.003792
C 3.017106 0.173258 -1.540834
C 2.105446 0.202812 -0.339751
C -2.252878 0.656911 -0.354991
C -2.033579 0.308831 0.982770
C -3.273497 0.029437 -1.080832
C -3.862203 -1.282457 0.872911
C -2.833917 -0.655612 1.596799
C -4.076461 -0.934086 -0.473302
C -4.712047 -2.323197 1.521780
H 5.039835 -1.626635 1.122500
H 4.448370 -3.232859 0.691562
H 3.739490 -2.388455 -1.575922
H 5.474444 -2.248801 -1.281378
H 2.743610 -2.163263 2.047027
H 2.106615 -2.300883 0.405633
H 5.045858 -0.148006 -2.198714
H 4.917890 0.236249 -0.480920
H 3.526772 0.293268 1.266917
H 1.871729 -0.020443 1.798631
H 2.540437 -0.448447 -2.331694
H 3.085959 1.200596 -1.962148
H 0.751269 1.288721 -2.324971
H -1.230873 0.792830 1.551570
H -3.444680 0.301070 -2.130043
H -2.658676 -0.920760 2.637263
H -4.868933 -1.416397 -1.041736
H -5.729712 -2.353334 1.107832
H -4.276633 -3.324604 1.377615
H -4.812517 -2.169860 2.605333


%chk=000277907-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277907

0 1
S -1.251576 1.924188 -0.820526
O -1.722417 2.410580 -2.303206
O -0.952706 2.979633 0.380570
N 1.056633 0.579018 -0.117039
N 0.309224 0.838941 -1.253388
C 4.660748 -2.088328 0.431611
C 4.565227 -1.958094 -1.107453
C 3.408044 -1.642659 1.220332
C 4.418754 -0.505725 -1.631263
C 3.030188 -0.140749 1.057221
C 2.977550 0.048766 -1.600010
C 2.313851 0.187393 -0.235601
C -2.432594 0.619310 -0.176682
C -2.510847 0.421064 1.210194
C -3.213248 -0.082066 -1.108647
C -4.236113 -1.291577 0.783330
C -3.426391 -0.546122 1.680742
C -4.121841 -1.040784 -0.610592
C -5.195626 -2.347279 1.301539
H 5.532762 -1.497470 0.783273
H 4.879565 -3.145249 0.685428
H 3.717606 -2.568522 -1.483027
H 5.482530 -2.399283 -1.545539
H 3.590208 -1.829902 2.297048
H 2.537287 -2.266727 0.936511
H 4.759312 -0.469027 -2.684681
H 5.098469 0.161734 -1.064414
H 3.953862 0.468918 1.140153
H 2.359951 0.164532 1.879784
H 2.325929 -0.595216 -2.230950
H 2.967861 1.046726 -2.098607
H 0.758411 1.376174 -2.031606
H -1.893261 1.015326 1.890496
H -3.127660 0.133332 -2.178455
H -3.513486 -0.721374 2.759156
H -4.752002 -1.598149 -1.313113
H -6.075651 -2.453962 0.643868
H -4.700995 -3.336740 1.351555
H -5.552956 -2.107533 2.317891


