%chk=000180064.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180064

0 1
P -3.574995 1.073371 0.062318
O -2.465566 1.548333 1.194692
O -2.900099 -0.225563 -0.652101
O 0.967083 1.917650 0.636708
O -4.652811 0.370301 1.085582
O 0.729022 0.607254 -1.904279
O 0.261935 -3.595527 0.685251
O -4.031838 2.114716 -0.861844
O 4.950781 1.471600 0.658746
O 3.159984 1.763533 -0.644688
N -0.301332 -1.975479 -0.817743
C 2.078222 -2.320875 -0.271257
C 2.408357 -0.976321 0.377284
C -0.293404 1.506941 0.102547
C -1.745048 -2.270133 -0.733067
C -1.400213 2.393403 0.707891
C -2.488601 -1.326976 0.221845
C 0.619519 -2.698515 -0.061525
C 3.828010 -0.506433 0.030386
C -0.272334 1.515168 -1.435285
C 3.884335 0.988735 -0.047470
H 2.315263 -2.311411 -1.354752
H 2.705616 -3.127820 0.167537
H 2.293183 -1.046353 1.479108
H 1.669091 -0.203490 0.053669
H -0.384251 0.461551 0.501920
H -1.888802 -3.327053 -0.392638
H -2.192782 -2.181115 -1.753600
H -1.780758 3.179566 0.029928
H -1.032006 2.870453 1.644322
H -1.847401 -0.947969 1.041217
H -3.401140 -1.800045 0.635615
H 4.561804 -0.891093 0.774416
H 4.161700 -0.920824 -0.948301
H -0.020564 -1.175613 -1.402354
H -1.206748 1.109015 -1.878228
H -0.081117 2.519503 -1.852738
H 1.381229 2.638598 0.106964
H -5.346959 0.945911 1.494981
H 1.632624 0.911352 -1.588852
H 5.026610 2.465553 0.628097


%chk=000180064-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180064

0 1
P -3.658034 1.031689 -0.067001
O -2.640103 1.553834 1.244524
O -2.931433 -0.345352 -0.762562
O 0.947244 2.334861 0.845276
O -4.908022 0.302580 0.853904
O 0.556037 0.711224 -1.747185
O 0.531104 -3.646941 0.448702
O -3.995018 2.158379 -1.125772
O 5.436761 0.921870 -0.575989
O 3.230274 1.032929 -1.212854
N -0.324894 -1.911567 -0.862639
C 2.103034 -1.979144 -0.434304
C 2.490026 -1.057435 0.752398
C -0.320414 1.774293 0.328256
C -1.696506 -2.426551 -0.814448
C -1.531116 2.507501 0.952263
C -2.659686 -1.591348 0.030853
C 0.709647 -2.592123 -0.243228
C 3.917718 -0.487993 0.641833
C -0.326450 1.743020 -1.213939
C 4.104576 0.532818 -0.460537
H 2.155713 -1.421724 -1.385965
H 2.816597 -2.821703 -0.486482
H 2.421471 -1.642448 1.688008
H 1.777852 -0.217512 0.839147
H -0.328352 0.738902 0.710745
H -1.640848 -3.439763 -0.373096
H -2.109268 -2.509007 -1.837221
H -1.911484 3.333796 0.319089
H -1.247740 2.885529 1.947012
H -2.220351 -1.324331 1.009088
H -3.622115 -2.111936 0.177100
H 4.208654 0.012296 1.586948
H 4.664917 -1.290362 0.487899
H -0.110727 -1.024057 -1.357169
H -1.328540 1.497467 -1.601330
H -0.052472 2.747222 -1.611964
H 1.155175 3.174360 0.359349
H -5.382888 0.902094 1.482312
H 1.516172 0.889675 -1.509612
H 5.529089 1.598853 -1.301108


