%chk=000262754.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262754

0 1
S 1.913607 0.606792 -0.594410
O -2.423545 -0.923954 0.896485
O 2.347665 -1.774990 0.560054
O 1.982383 -3.680144 -0.575698
O -2.297733 -1.922927 -1.175989
O 3.904714 2.283038 0.348175
O 4.146912 -0.319234 -1.711053
O 5.143439 0.524459 1.114881
N -0.391167 -1.327989 0.029669
C 0.556909 -1.718942 -1.027364
C 1.129227 -0.517920 -1.776844
C 1.675650 -2.537221 -0.364369
C -3.890063 -0.931377 0.830643
C -4.367901 0.290786 0.102074
C -1.762215 -1.433569 -0.201977
C -4.441852 0.283199 -1.299080
C -4.742646 1.437802 0.815758
C -4.898463 1.414184 -1.979513
C -5.200469 2.566826 0.130033
C 3.647285 0.299268 -0.825368
C -5.280442 2.555597 -1.266128
C 4.362633 1.002125 0.337194
C 4.401153 3.192741 1.392353
C 3.749739 2.861315 2.715315
H 0.025643 -2.402040 -1.766172
H 0.324668 0.039658 -2.304408
H 1.848981 -0.835631 -2.564668
H -0.030264 -0.819648 0.841433
H -4.138620 -0.935041 1.909363
H -4.226002 -1.873801 0.356625
H -4.130275 -0.607669 -1.853516
H -4.675260 1.454131 1.902399
H -4.957133 1.405972 -3.066922
H -5.493796 3.456393 0.684939
H -5.638799 3.435466 -1.798085
H 3.060612 -2.293240 1.038718
H 5.502089 3.117853 1.421015
H 4.079466 4.164491 0.972269
H 4.097924 1.892605 3.105416
H 2.656571 2.798993 2.625136
H 3.976774 3.619844 3.475115


%chk=000262754-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262754

0 1
S 1.528906 0.502708 -0.929036
O -2.490486 -1.353730 0.704629
O 2.020361 -2.472022 1.009529
O 2.514858 -3.843685 -0.808267
O -2.117176 -1.887775 -1.570455
O 3.282405 2.419087 0.249172
O 3.893326 -0.891072 -0.894252
O 5.051077 1.041833 0.923056
N -0.389317 -1.871627 0.006827
C 0.631760 -2.263711 -0.963886
C 1.112347 -1.085233 -1.867286
C 1.811087 -2.960785 -0.287057
C -3.937937 -1.082545 0.389807
C -4.170711 0.365984 0.019320
C -1.696882 -1.715036 -0.392208
C -4.043316 0.791361 -1.328962
C -4.523653 1.314211 1.012952
C -4.260446 2.143749 -1.673124
C -4.741750 2.667225 0.669504
C 3.294867 0.147329 -0.546867
C -4.610362 3.084335 -0.675615
C 3.989590 1.233228 0.296467
C 3.822195 3.564575 1.059169
C 3.352414 3.463123 2.511752
H 0.189109 -3.001594 -1.659025
H 0.286610 -0.796838 -2.536972
H 2.000286 -1.378544 -2.451667
H -0.113086 -1.660701 0.967095
H -4.444220 -1.354155 1.329179
H -4.236752 -1.765690 -0.423575
H -3.763234 0.058638 -2.094074
H -4.626190 0.991035 2.056381
H -4.161216 2.463878 -2.716340
H -5.016776 3.391627 1.444276
H -4.782282 4.132786 -0.944503
H 2.836778 -2.887052 1.397973
H 4.923691 3.548600 0.982753
H 3.413291 4.448062 0.545738
H 3.783131 2.576893 3.006806
H 2.251958 3.409331 2.567665
H 3.683144 4.360399 3.066618


