%chk=000250910.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250910

0 1
S 0.000510 1.886874 0.000629
O -0.133132 2.615239 -1.255955
O 0.135662 2.614234 1.257632
N 4.743475 -1.657092 -0.542508
N -4.749762 -1.647613 0.541699
N 5.287216 -2.433500 0.520579
N -5.295273 -2.422088 -0.521880
C 1.359521 0.824128 -0.140239
C -1.360683 0.826843 0.140877
C 1.770975 0.369876 -1.400111
C -1.773006 0.372603 1.400468
C 2.080080 0.451048 0.997528
C -2.082084 0.456018 -0.997095
C 3.575132 -0.876942 -0.367651
C -3.579816 -0.869769 0.367289
C 2.858289 -0.485963 -1.526137
C -2.862089 -0.481055 1.525991
C 3.177252 -0.402958 0.902035
C -3.181024 -0.395766 -0.902107
H 1.234293 0.697339 -2.298650
H -1.235588 0.698344 2.299193
H 1.787078 0.841787 1.980223
H -1.788319 0.846799 -1.979547
H 3.169565 -0.830519 -2.508931
H -3.174024 -0.825616 2.508575
H 3.728710 -0.662825 1.799223
H -3.733072 -0.653884 -1.799437
H 4.801998 -2.203033 -1.415793
H -4.809392 -2.194017 1.414613
H 5.985154 -1.857656 1.011109
H 4.581259 -2.696986 1.218351
H -5.991811 -1.844307 -1.012116
H -4.589893 -2.686846 -1.219756


%chk=000250910-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250910

0 1
S 0.000456 1.807786 0.000619
O -0.142866 2.585432 -1.438447
O 0.145468 2.584300 1.440126
N 4.932009 -1.711573 -0.517063
N -4.938436 -1.701609 0.516179
N 5.748819 -2.142513 0.538387
N -5.756064 -2.130319 -0.539547
C 1.502144 0.684984 -0.148600
C -1.503647 0.688122 0.149182
C 1.928144 0.294804 -1.431995
C -1.930409 0.297972 1.432334
C 2.198285 0.333650 1.018859
C -2.200581 0.339036 -1.018478
C 3.795222 -0.908585 -0.375024
C -3.800021 -0.900847 0.374635
C 3.074670 -0.508589 -1.543595
C -3.078602 -0.503109 1.543442
C 3.348396 -0.472221 0.907719
C -3.352364 -0.464518 -0.907830
H 1.386687 0.642208 -2.318199
H -1.388200 0.643641 2.318757
H 1.859181 0.710554 1.989844
H -1.860743 0.715884 -1.989227
H 3.427710 -0.822214 -2.533437
H -3.432249 -0.816662 2.533091
H 3.905159 -0.754972 1.806190
H -3.909761 -0.745490 -1.806466
H 5.237654 -1.991032 -1.448747
H -5.244562 -1.981159 1.447678
H 6.257288 -1.390297 1.016438
H 5.305789 -2.822462 1.165642
H -6.263069 -1.376814 -1.017122
H -5.314307 -2.810692 -1.167245


