%chk=000275350.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275350

0 1
S 0.053709 1.916230 -0.087594
O -0.097552 2.371170 1.283149
O 0.148540 2.880720 -1.166936
N -1.281603 0.927927 -0.510406
C -2.022273 0.190310 0.554292
C -2.869869 -0.930344 -0.088147
C -2.156908 -2.296715 -0.191515
C -2.905157 1.140533 1.376419
C -1.818325 -2.858003 1.195828
C -0.906417 -2.227510 -1.073307
C 1.391191 0.817546 -0.150845
C 1.919456 0.430715 -1.385579
C 1.942560 0.326401 1.036556
C 2.996656 -0.460244 -1.434478
C 3.019186 -0.563869 0.989505
C 3.543792 -0.957514 -0.246885
H -1.258474 -0.271608 1.238217
H -3.205677 -0.623973 -1.097676
H -3.800943 -1.064182 0.497084
H -2.880650 -3.001907 -0.678104
H -1.896849 1.273179 -1.257366
H -3.666700 1.637673 0.769214
H -3.419143 0.611599 2.185002
H -2.298332 1.930827 1.851826
H -2.713726 -2.959466 1.817374
H -1.354406 -3.847107 1.120195
H -1.116595 -2.209817 1.733663
H -1.136176 -1.799764 -2.055175
H -0.130862 -1.591171 -0.629407
H -0.471872 -3.219143 -1.229931
H 1.499600 0.828366 -2.315052
H 1.538144 0.646906 2.003971
H 3.409879 -0.762346 -2.395488
H 3.450756 -0.946342 1.913066
H 4.384039 -1.651879 -0.284371


%chk=000275350-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275350

0 1
S 0.081820 1.824883 0.040295
O -0.092631 2.347845 1.580413
O 0.210889 2.849791 -1.221852
N -1.302427 0.646635 -0.453877
C -2.211421 0.225929 0.661097
C -3.017090 -1.020450 0.192390
C -2.238573 -2.318565 -0.172935
C -3.161513 1.352811 1.132666
C -1.158279 -2.676851 0.876076
C -1.639269 -2.289884 -1.600184
C 1.577034 0.670672 0.038382
C 2.146682 0.333393 -1.199797
C 2.071523 0.233904 1.276870
C 3.278424 -0.513784 -1.188833
C 3.204123 -0.614302 1.266033
C 3.799751 -0.988675 0.038875
H -1.559246 -0.067853 1.504678
H -3.658399 -0.726790 -0.664963
H -3.707993 -1.248732 1.030300
H -2.997720 -3.130611 -0.154176
H -1.807557 1.190608 -1.184916
H -3.828406 1.671022 0.307683
H -3.799350 1.001386 1.964510
H -2.583933 2.223405 1.486827
H -1.570027 -2.674454 1.903813
H -0.747412 -3.684536 0.679892
H -0.314415 -1.963250 0.838390
H -2.422503 -2.089662 -2.356471
H -0.875531 -1.498044 -1.680152
H -1.172100 -3.262195 -1.847127
H 1.734726 0.732926 -2.131828
H 1.600948 0.566319 2.207913
H 3.751497 -0.797621 -2.134587
H 3.619882 -0.974083 2.212921
H 4.677495 -1.643989 0.038770


