%chk=000289859.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289859

0 1
S -1.361872 -1.044294 -2.472308
O -2.263933 -0.798295 -3.574595
O -0.474325 -2.179632 -2.450279
O 1.645799 -1.893763 1.393486
O 2.369177 4.418041 -1.654036
O 3.727413 -1.056569 1.714338
O 3.544162 4.121731 0.253391
O -1.254932 -3.458075 2.126905
O -2.706182 -2.567992 3.451676
N -0.409442 0.405980 -2.472586
N -2.140556 -2.654034 2.361477
N -4.349074 -0.716587 2.616888
C -2.208431 -0.981535 -0.982253
C 0.663032 0.683526 -1.594435
C -1.854072 -1.799922 0.076709
C -3.307827 -0.094737 -0.846027
C 1.203263 1.989302 -1.560438
C 1.175861 -0.302817 -0.728719
C -2.558313 -1.754254 1.301346
C 2.209877 2.296996 -0.642815
C 2.159523 0.042374 0.202193
C -3.648245 -0.833518 1.454328
C -4.008278 -0.013544 0.332152
C 2.691759 1.334960 0.256804
C 2.655033 -0.983311 1.166554
C 2.797665 3.664322 -0.579386
C 1.938225 -2.998001 2.292745
C 2.874232 5.779238 -1.725317
H -0.550636 1.086512 -3.232038
H -1.011273 -2.514066 -0.012189
H -3.601589 0.528180 -1.701907
H 0.844500 2.761746 -2.245347
H 0.845621 -1.348161 -0.785709
H -4.847974 0.673741 0.425339
H 3.474127 1.590882 0.980463
H -4.116813 -1.281790 3.442143
H -5.115157 -0.067905 2.708132
H 0.946992 -3.454624 2.431833
H 2.353111 -2.620436 3.232035
H 2.637156 -3.680841 1.801441
H 2.495761 6.352063 -0.873092
H 2.465170 6.134411 -2.676672
H 3.969464 5.768500 -1.727930


%chk=000289859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289859

0 1
S -1.679235 0.115220 -2.043665
O -2.728874 0.743768 -3.122974
O -0.457314 -0.877862 -2.456133
O 1.588010 -1.285360 1.943654
O 3.172120 4.325901 -2.324220
O 3.780168 -0.495012 2.070375
O 4.925520 3.453990 -1.061141
O -0.953223 -3.709374 1.568020
O -2.883119 -4.088314 2.714012
N -0.992581 1.713040 -1.074301
N -2.197587 -3.453768 1.794514
N -5.029139 -2.669694 2.179268
C -2.681052 -0.750672 -0.723070
C 0.384867 1.653390 -0.728086
C -2.086599 -1.763165 0.021313
C -4.029283 -0.356586 -0.543510
C 1.341654 2.539174 -1.290173
C 0.798668 0.703457 0.241467
C -2.863161 -2.416932 1.010894
C 2.685261 2.502447 -0.846929
C 2.150398 0.632611 0.638433
C -4.244726 -2.058702 1.238629
C -4.793775 -1.010896 0.420932
C 3.096180 1.542599 0.108520
C 2.615897 -0.402616 1.614647
C 3.715267 3.440943 -1.387987
C 1.943302 -2.400638 2.855733
C 4.131141 5.284388 -2.922813
H -1.212027 2.459202 -1.764755
H -1.051464 -2.080099 -0.143414
H -4.457476 0.429800 -1.173026
H 1.053038 3.263534 -2.059018
H 0.072388 0.026709 0.696382
H -5.841240 -0.727501 0.570284
H 4.141773 1.499012 0.429042
H -4.607968 -3.417488 2.743433
H -5.997584 -2.382830 2.306186
H 1.080911 -3.079625 2.810344
H 2.102516 -2.012171 3.875866
H 2.864408 -2.895886 2.506620
H 4.574283 5.919977 -2.138035
H 3.531833 5.879265 -3.625824
H 4.935821 4.740567 -3.445197


