%chk=000187169.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187169

0 1
O -4.827501 2.244865 0.000137
C 0.736738 -0.212502 0.000053
C -0.207185 0.826370 0.000051
C 2.149829 0.084918 0.000052
C 0.302322 -1.588759 0.000042
C -1.617550 0.514524 0.000035
C -2.032161 -0.848480 -0.000045
C 2.587402 1.433698 0.000040
C 3.112348 -0.971875 0.000059
C -1.044481 -1.879015 -0.000016
C 0.267425 2.190309 0.000039
C 1.316143 -2.638490 0.000075
C -3.440337 -1.160024 -0.000136
C 1.596145 2.483285 0.000034
C 2.635205 -2.350660 0.000081
C -2.597328 1.545490 0.000092
C 3.974923 1.713420 0.000034
C 4.471767 -0.664353 0.000045
C -4.378068 -0.148587 -0.000073
C -3.932806 1.201964 0.000055
C 4.895899 0.677537 0.000033
C -3.895929 -2.583569 -0.000298
H -1.370797 -2.919535 -0.000059
H -0.479111 2.988836 0.000036
H 0.961998 -3.669430 0.000119
H 1.944710 3.515171 0.000023
H 3.389032 -3.137454 0.000116
H -2.301461 2.593303 0.000164
H 4.310758 2.748643 0.000025
H 5.214729 -1.459431 0.000044
H -5.441194 -0.364516 -0.000126
H 5.963601 0.896509 0.000025
H -3.530831 -3.121209 -0.888328
H -3.531056 -3.121342 0.887743
H -4.990240 -2.679847 -0.000444
H -5.765038 1.932237 0.000074


%chk=000187169-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187169

0 1
O -4.916939 2.273870 0.000001
C 0.755522 -0.206879 0.000007
C -0.210244 0.854351 0.000019
C 2.166286 0.084810 0.000039
C 0.316656 -1.591560 -0.000036
C -1.632606 0.540278 -0.000011
C -2.048736 -0.853312 -0.000058
C 2.622062 1.452007 0.000081
C 3.135126 -0.986472 0.000029
C -1.057987 -1.879675 -0.000069
C 0.278717 2.211977 0.000059
C 1.313072 -2.645256 -0.000047
C -3.460234 -1.179180 -0.000092
C 1.635027 2.500914 0.000089
C 2.662482 -2.358165 -0.000015
C -2.632477 1.559298 0.000007
C 4.021452 1.725736 0.000114
C 4.517691 -0.672181 0.000063
C -4.401764 -0.147349 -0.000073
C -3.985201 1.219650 -0.000022
C 4.955394 0.673790 0.000104
C -3.926885 -2.623443 -0.000143
H -1.372193 -2.928838 -0.000102
H -0.433050 3.041773 0.000064
H 0.965151 -3.685217 -0.000081
H 1.976373 3.542859 0.000119
H 3.405592 -3.164239 -0.000022
H -2.375851 2.620482 0.000046
H 4.361521 2.767929 0.000146
H 5.251408 -1.486990 0.000056
H -5.473724 -0.389345 -0.000100
H 6.028294 0.895031 0.000130
H -3.560435 -3.169357 -0.890189
H -3.560521 -3.169391 0.889918
H -5.028220 -2.682103 -0.000198
H -5.842858 1.926198 -0.000031


