%chk=000205971.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205971

0 1
S -3.374949 0.533172 0.679782
O 2.155197 -2.317706 0.634441
O -4.660701 -0.081391 0.410085
O -2.964268 0.873287 2.028689
N 2.079428 -0.063307 0.983721
N 4.273531 1.562498 -0.018962
N -3.352008 2.012004 -0.215465
N 0.770872 -2.968220 -1.692401
C 3.438821 -0.126411 1.597309
C 1.833873 1.242152 0.315173
C 4.544372 0.212968 0.578768
C 2.942933 1.565108 -0.711211
C 1.527778 -1.267714 0.503116
C 5.357466 1.935354 -0.975364
C 0.154172 -1.248826 -0.062724
C -0.853901 -0.457675 0.498187
C -2.145262 -0.452423 -0.025576
C -0.181329 -2.138272 -1.129651
C -2.462254 -1.300735 -1.102566
C -1.504929 -2.127411 -1.658735
C -2.156692 2.861343 -0.019114
C -3.808115 1.918683 -1.619959
H 3.609081 -1.143815 2.020455
H 3.453870 0.599351 2.442203
H 1.815262 2.026167 1.109850
H 0.847079 1.255152 -0.189739
H 5.522633 0.260507 1.104923
H 4.622833 -0.596461 -0.178682
H 2.890734 0.856161 -1.564817
H 2.772421 2.583619 -1.122710
H 5.479154 1.256675 -1.832128
H 6.314581 1.978743 -0.429455
H 5.164833 2.950360 -1.359189
H -0.622153 0.161427 1.378906
H -3.488586 -1.317648 -1.492023
H -1.762326 -2.787037 -2.483273
H 0.483971 -3.697515 -2.325708
H 1.633705 -3.157747 -1.176919
H -1.252839 2.496511 -0.530692
H -1.950636 2.954167 1.066184
H -2.365363 3.883099 -0.384424
H -3.087108 1.438873 -2.300055
H -4.021189 2.930535 -2.008748
H -4.766488 1.362996 -1.654304


%chk=000205971-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205971

0 1
S -3.280108 0.743000 0.768115
O 2.225245 -2.571431 0.299802
O -4.774943 0.105388 0.691486
O -2.582987 1.257245 2.147136
N 2.232564 -0.276498 0.654182
N 4.306027 1.678665 0.171331
N -3.369686 2.302666 -0.327788
N 0.479984 -3.412823 -1.543295
C 3.547068 -0.370526 1.336887
C 1.881003 1.104628 0.249047
C 4.661500 0.276070 0.494841
C 3.030292 1.730811 -0.573351
C 1.593848 -1.447413 0.263199
C 5.394966 2.398754 -0.517140
C 0.156563 -1.405536 -0.165583
C -0.758306 -0.477934 0.389236
C -2.099247 -0.487986 -0.014965
C -0.343611 -2.413004 -1.079010
C -2.599403 -1.412274 -0.957557
C -1.719209 -2.365600 -1.481903
C -2.050724 2.969486 -0.381160
C -3.973976 1.981431 -1.640358
H 3.761448 -1.435570 1.513851
H 3.469072 0.163198 2.303775
H 1.704097 1.720517 1.152595
H 0.967435 1.096562 -0.363260
H 5.601500 0.271966 1.076885
H 4.826830 -0.335267 -0.428832
H 3.100405 1.197298 -1.558248
H 2.779702 2.788299 -0.780157
H 5.653255 1.963190 -1.515136
H 6.304263 2.380259 0.109483
H 5.106376 3.454377 -0.667879
H -0.446278 0.214007 1.178713
H -3.661640 -1.411703 -1.222608
H -2.090680 -3.121756 -2.182990
H 0.120498 -4.123198 -2.176245
H 1.379069 -3.534703 -1.056002
H -1.312907 2.465448 -1.049097
H -1.647412 3.038754 0.643033
H -2.213934 3.996974 -0.754545
H -3.284384 1.461079 -2.344147
H -4.290512 2.935323 -2.100488
H -4.875560 1.368425 -1.474654


