%chk=000277888.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277888

0 1
S 1.049025 1.787167 -0.692884
O 1.201277 2.209822 -2.079872
O 1.019487 2.782374 0.341811
O -0.359022 0.159545 1.233638
N -0.566946 1.057471 -0.789085
N -1.355449 1.250552 -1.957108
C 2.140005 0.521595 -0.355141
C 2.344378 0.081212 0.959856
C 2.862257 -0.067727 -1.405182
C 3.982493 -1.528199 0.174849
C -1.114911 0.314914 0.283092
C 3.260933 -0.937128 1.224294
C 3.775479 -1.084693 -1.146538
C -2.512403 -0.195314 0.245590
C 4.949574 -2.628575 0.452311
C -3.011879 -0.917015 -0.845406
C -3.317524 0.032918 1.373869
C -4.321920 -1.406390 -0.808595
C -4.626304 -0.451908 1.399780
C -5.128071 -1.171894 0.308964
H 1.773458 0.530087 1.786393
H 2.711289 0.280567 -2.434520
H 3.408008 -1.275432 2.248936
H 4.331170 -1.537704 -1.965272
H 5.771220 -2.664538 -0.276692
H 5.408675 -2.545326 1.447872
H 4.444119 -3.607243 0.415130
H -1.795794 2.180732 -1.917637
H -0.731798 1.260441 -2.781747
H -2.385254 -1.089076 -1.722729
H -2.914199 0.583030 2.226402
H -4.712986 -1.967748 -1.655412
H -5.254783 -0.272541 2.270528
H -6.149302 -1.550874 0.332604


%chk=000277888-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277888

0 1
S 1.078536 1.661823 -0.718813
O 1.267626 2.093885 -2.294291
O 1.090579 2.828548 0.422540
O -0.665285 0.234078 1.187435
N -0.757900 0.627147 -1.081036
N -1.405779 1.171291 -2.149077
C 2.372148 0.356139 -0.326663
C 2.524841 -0.051394 1.008166
C 3.159586 -0.125837 -1.384137
C 4.360410 -1.523240 0.257267
C -1.378376 0.262873 0.137138
C 3.534695 -0.997483 1.287513
C 4.160718 -1.073023 -1.074469
C -2.822663 -0.159855 0.153139
C 5.420914 -2.562592 0.571817
C -3.555326 -0.561181 -0.995243
C -3.448018 -0.198165 1.429644
C -4.896873 -0.981759 -0.865029
C -4.791403 -0.605210 1.551874
C -5.520567 -0.998216 0.404160
H 1.872590 0.347840 1.789718
H 3.005499 0.246020 -2.401915
H 3.680348 -1.333035 2.320654
H 4.797367 -1.461120 -1.877907
H 6.251396 -2.528142 -0.154295
H 5.841657 -2.419916 1.582376
H 4.993379 -3.583426 0.535795
H -1.909112 2.061303 -2.018142
H -0.862894 1.103314 -3.016731
H -3.078046 -0.550752 -1.978584
H -2.859343 0.091766 2.305725
H -5.453757 -1.299671 -1.753134
H -5.268795 -0.619471 2.537539
H -6.563848 -1.319436 0.499065


