%chk=000253526.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253526

0 1
O 0.413206 3.496198 0.000472
O 2.360832 2.578882 -0.000342
O -3.587095 1.266659 -0.000007
O -3.780542 -0.882522 -0.000170
N -1.690886 -2.408964 -0.000094
N 1.142234 2.513566 0.000054
N -3.104400 0.150113 0.000140
C 0.467931 -1.264365 -0.000121
C 1.208291 -0.050616 -0.000010
C -0.993358 -1.241882 -0.000067
C 0.478516 1.202322 0.000060
C -1.659236 0.017337 0.000066
C -0.901612 1.214147 0.000125
C 1.170476 -2.503658 -0.000267
C 2.627806 -0.123422 0.000052
C 2.547058 -2.545769 -0.000253
C 3.282262 -1.336565 -0.000071
H -1.451329 2.178927 0.000205
H 0.612619 -3.441927 -0.000391
H 3.216314 0.806383 0.000198
H 3.077616 -3.497408 -0.000380
H 4.374051 -1.373455 -0.000025
H -2.722734 -2.415388 0.000001
H -1.227822 -3.307093 -0.000175


%chk=000253526-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253526

0 1
O 0.329797 3.587096 0.001202
O 2.400140 2.661712 -0.001016
O -3.625663 1.318585 0.000438
O -3.843044 -0.945367 0.000203
N -1.706938 -2.424412 -0.000282
N 1.108751 2.554042 0.000023
N -3.102296 0.141857 0.000010
C 0.474555 -1.274201 -0.000142
C 1.234484 -0.039350 -0.000094
C -0.990782 -1.265933 -0.000159
C 0.484383 1.209696 0.000005
C -1.646996 0.009930 -0.000052
C -0.906622 1.214536 0.000042
C 1.174237 -2.520610 -0.000192
C 2.664482 -0.129627 0.000032
C 2.570412 -2.578209 -0.000123
C 3.315232 -1.369205 0.000039
H -1.444620 2.165535 0.000152
H 0.628435 -3.469935 -0.000290
H 3.242068 0.793153 0.000048
H 3.082169 -3.545505 -0.000179
H 4.409652 -1.401253 0.000120
H -2.735692 -2.325916 -0.000434
H -1.255948 -3.335117 -0.000351


