%chk=000240858.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240858

0 1
O 4.451980 -0.223560 -0.000323
O -5.465731 0.173413 0.000869
O -4.144561 -1.673750 0.000368
N -1.946386 0.154791 -0.000058
N -3.264500 0.546088 0.000037
C 0.393557 0.666457 -0.000252
C 3.091051 -0.033799 -0.000250
C 1.387545 1.670010 -0.000565
C 0.775951 -0.685692 0.000047
C 2.732924 1.332954 -0.000564
C 2.124623 -1.047521 0.000046
C -1.019964 1.076101 -0.000252
C 4.948375 -1.585096 0.000346
C -4.230519 -0.473529 0.000406
H 1.100005 2.721991 -0.000813
H 0.008069 -1.466796 0.000272
H 3.514131 2.089714 -0.000805
H 2.400431 -2.096987 0.000257
H -1.194269 2.163431 -0.000263
H 4.628259 -2.106530 -0.906210
H 4.627838 -2.105864 0.907133
H 6.034806 -1.426381 0.000545
H -3.569329 1.527529 0.000199
H -6.211486 -0.485473 0.001026


%chk=000240858-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240858

0 1
O 4.535014 -0.187503 -0.000310
O -5.542914 0.324736 0.000346
O -4.283092 -1.669561 0.000793
N -1.981681 0.055657 0.000244
N -3.295212 0.493237 0.000246
C 0.375857 0.630336 -0.000127
C 3.148448 0.006727 -0.000224
C 1.356942 1.663942 -0.000487
C 0.814600 -0.722447 0.000175
C 2.727210 1.360996 -0.000537
C 2.185052 -1.039176 0.000128
C -1.044843 0.983525 -0.000080
C 5.032682 -1.567232 0.000185
C -4.336987 -0.424016 0.000572
H 1.038780 2.714162 -0.000726
H 0.060883 -1.516489 0.000444
H 3.488701 2.146640 -0.000808
H 2.492625 -2.089170 0.000356
H -1.286559 2.067199 -0.000347
H 4.703021 -2.113221 -0.904907
H 4.703008 -2.112576 0.905659
H 6.128380 -1.474687 0.000157
H -3.545519 1.492580 -0.000002
H -6.301596 -0.312159 0.000445


