%chk=000263446.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000263446

0 1
S 1.175758 0.660032 1.795290
S -2.899595 -1.850292 0.869291
O -1.916528 -1.416822 -0.437530
O -3.717955 -2.935745 0.407893
O -3.507318 -0.628632 1.337212
N 0.541311 0.241668 -1.229291
C -0.753356 -0.033838 -1.916266
C -1.965024 -0.069357 -0.954497
C 1.109120 -0.858292 -0.500753
C 0.713739 1.588553 -0.755820
C 1.513759 -0.767647 0.841774
C 1.069610 1.902217 0.566444
C -3.283149 0.154311 -1.678114
C 1.340292 -2.066959 -1.195115
C 0.587788 2.639085 -1.690073
C 2.157178 -1.830618 1.479086
C 1.310233 3.219920 0.959124
C 1.960281 -3.134370 -0.549487
C 0.811237 3.956434 -1.291358
C 2.372070 -3.022452 0.785193
C 1.171551 4.252566 0.028774
C -1.678421 -2.413434 1.961534
H -0.908120 0.733595 -2.705919
H -0.682095 -1.017566 -2.439893
H -1.843101 0.638442 -0.100464
H -4.119288 0.223994 -0.961965
H -3.517515 -0.670152 -2.364198
H -3.287677 1.086304 -2.253068
H 1.036679 -2.161052 -2.237372
H 0.332541 2.419614 -2.725623
H 2.491291 -1.733153 2.513525
H 1.599865 3.446609 1.986984
H 2.132941 -4.064244 -1.092313
H 0.709911 4.762726 -2.018216
H 2.866825 -3.858298 1.274836
H 1.347193 5.283614 0.328788
H -1.564042 -1.776276 2.853994
H -1.853402 -3.435337 2.330362
H -0.670189 -2.436947 1.502032


%chk=000263446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000263446

0 1
S 1.379645 0.064888 2.039225
S -3.346224 -0.674140 1.201175
O -2.410074 -1.243674 -0.345177
O -4.793854 -1.389648 1.239151
O -3.228749 0.944050 1.287596
N 0.323102 -0.142069 -0.820953
C -0.706323 -0.451844 -1.827805
C -2.143775 -0.163102 -1.323213
C 1.334532 -1.106450 -0.520190
C 0.466504 1.206533 -0.365324
C 1.969949 -1.108514 0.752537
C 1.013625 1.477302 0.918499
C -3.186774 -0.198043 -2.448261
C 1.761826 -2.067888 -1.476660
C 0.089394 2.312155 -1.174582
C 2.988925 -2.029466 1.063301
C 1.205834 2.795941 1.371522
C 2.752683 -3.019480 -1.152695
C 0.243269 3.634642 -0.706649
C 3.373622 -3.006225 0.116010
C 0.807150 3.885619 0.563308
C -2.178449 -1.499085 2.444716
H -0.547593 0.094064 -2.781780
H -0.654519 -1.528280 -2.055201
H -2.176368 0.810962 -0.793203
H -4.198805 -0.061909 -2.030710
H -3.163374 -1.166187 -2.979587
H -3.006228 0.612608 -3.178996
H 1.333706 -2.064653 -2.483799
H -0.318904 2.144744 -2.175759
H 3.468032 -1.989688 2.047298
H 1.645922 2.967754 2.359392
H 3.052339 -3.758110 -1.903975
H -0.070422 4.468821 -1.343381
H 4.150996 -3.735384 0.364930
H 0.932807 4.910876 0.925142
H -1.197939 -1.017875 2.306508
H -2.614092 -1.317537 3.437467
H -2.166998 -2.563508 2.174924


