%chk=000295703.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295703

0 1
S 0.016221 1.397521 -0.107007
S 1.255337 -3.843302 0.385893
O -3.977295 0.158150 0.685776
O -2.393375 1.727199 0.225799
N 0.549446 -1.254093 0.163080
N -1.191927 -2.896247 0.641941
C -1.757464 -0.560366 0.425038
C -0.391771 -0.278480 0.176663
C 1.756290 1.397779 -0.410327
C -2.693370 0.565346 0.422368
C -2.114698 -1.906528 0.656168
C 2.192308 1.794113 -1.676384
C 2.659000 1.098771 0.611598
C -5.027395 1.181644 0.686581
C 0.108383 -2.527605 0.393747
C 3.566085 1.908762 -1.916404
C 4.031095 1.209480 0.360387
C 4.482335 1.616934 -0.899886
C -5.378026 1.560185 -0.735893
C 2.823016 -3.049183 0.003950
H -3.160125 -2.188718 0.854768
H -5.836377 0.639353 1.209698
H -4.675868 2.041821 1.283932
H 1.478915 2.012376 -2.472077
H 2.304799 0.775293 1.590818
H 3.920889 2.222433 -2.896597
H 4.746936 0.981541 1.147934
H 5.550912 1.706714 -1.090773
H -6.260943 2.209274 -0.772997
H -4.550109 2.102622 -1.218803
H -5.586517 0.675434 -1.351345
H 3.099791 -2.294127 0.753438
H 2.800996 -2.536019 -0.968822
H 3.598106 -3.825576 -0.022464


%chk=000295703-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295703

0 1
S 0.145797 1.694681 -0.066454
S 1.339574 -3.636892 -0.025512
O -4.101462 0.089614 0.682890
O -2.658724 1.898374 0.342428
N 0.522920 -1.021335 -0.012912
N -1.166930 -2.745417 0.315928
C -1.791311 -0.370997 0.315910
C -0.413560 -0.044256 0.090634
C 1.965245 1.423311 -0.314195
C -2.847096 0.656611 0.437254
C -2.093491 -1.760088 0.417760
C 2.481498 1.303420 -1.622842
C 2.826254 1.434321 0.804739
C -5.247540 1.044381 0.801475
C 0.119051 -2.313012 0.102827
C 3.877713 1.179079 -1.811649
C 4.221823 1.309997 0.610730
C 4.748139 1.180788 -0.696187
C -5.818730 1.383204 -0.578065
C 2.909114 -2.636822 -0.303951
H -3.127608 -2.070378 0.588339
H -5.970484 0.498425 1.428237
H -4.895090 1.950652 1.324342
H 1.801179 1.305787 -2.480577
H 2.410687 1.537551 1.812337
H 4.282305 1.087287 -2.825674
H 4.893239 1.319513 1.476432
H 5.830006 1.090059 -0.844991
H -6.716725 2.017904 -0.460906
H -5.082001 1.938644 -1.181891
H -6.111798 0.467551 -1.119935
H 3.075206 -1.958084 0.543676
H 2.820570 -2.051158 -1.229083
H 3.717831 -3.380211 -0.381317


