%chk=000223786.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223786

0 1
O 1.591960 -0.197187 -2.170661
O 1.992054 -2.002655 2.076072
O -1.277025 -3.908705 0.028972
O -1.783719 1.817689 -1.835283
O -3.193086 2.184272 0.231482
N 1.806302 -1.430205 -0.186175
C 1.652325 -2.802937 -0.724671
C 0.328342 -3.003604 -1.469576
C 1.862288 0.893005 0.016293
C 1.977971 0.344589 1.324759
C 1.733836 -0.231677 -0.972016
C 1.929393 -1.152421 1.230161
C -0.869264 -2.916274 -0.537058
C 1.863777 2.255177 -0.189062
C 2.102072 1.154887 2.431820
C -1.506048 -1.582179 -0.337311
C 1.990129 3.091480 0.946885
C 2.107602 2.555532 2.223444
C -1.330074 -0.540510 -1.276133
C -2.283618 -1.375189 0.799552
C -1.901054 0.698234 -1.042303
C -2.694949 0.910895 0.137609
C -2.881782 -0.125742 1.044263
C -1.022527 1.671072 -3.062030
C -4.052256 2.479372 1.362342
H 2.501045 -3.005879 -1.419107
H 1.733124 -3.521552 0.129579
H 0.246656 -2.276240 -2.307539
H 0.334084 -4.008621 -1.945523
H 1.765759 2.682112 -1.187552
H 2.190576 0.738115 3.435916
H 1.989825 4.173766 0.806366
H 2.203312 3.216256 3.086583
H -0.738370 -0.723968 -2.176981
H -2.431094 -2.193263 1.511026
H -3.482761 0.008323 1.939122
H -1.540919 0.993546 -3.746092
H -0.000670 1.329430 -2.851512
H -1.027949 2.698159 -3.446921
H -4.944039 1.846519 1.339789
H -4.310941 3.529450 1.170386
H -3.498385 2.375428 2.299188


%chk=000223786-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223786

0 1
O 1.614291 0.024488 -1.991253
O 2.800805 -2.188176 2.000349
O -0.873938 -3.368871 0.819443
O -2.462138 1.845258 -2.044607
O -4.374192 1.970174 -0.218482
N 2.062440 -1.391329 -0.124656
C 1.675770 -2.699757 -0.686198
C 0.227225 -2.744966 -1.234367
C 2.540309 0.872681 0.155816
C 2.890185 0.214766 1.358853
C 2.018116 -0.148218 -0.808853
C 2.607286 -1.246432 1.197462
C -0.818244 -2.523400 -0.128568
C 2.700621 2.258075 0.006685
C 3.412414 0.917295 2.454439
C -1.743466 -1.353489 -0.174009
C 3.227414 2.980193 1.109437
C 3.577728 2.320242 2.314716
C -1.635375 -0.319338 -1.150480
C -2.762127 -1.262715 0.808205
C -2.513864 0.779590 -1.142595
C -3.545622 0.854582 -0.147438
C -3.655129 -0.175590 0.818714
C -1.425490 1.789975 -3.084565
C -5.442220 2.088808 0.780663
H 2.378822 -2.965907 -1.497382
H 1.788492 -3.428932 0.135220
H 0.123655 -2.055153 -2.083272
H 0.071939 -3.773112 -1.613904
H 2.428790 2.758220 -0.928120
H 3.678631 0.396010 3.379134
H 3.366056 4.063772 1.030966
H 3.981529 2.904074 3.148707
H -0.845831 -0.355678 -1.903706
H -2.831849 -2.059989 1.554599
H -4.437101 -0.130072 1.582431
H -1.578966 0.921192 -3.753984
H -0.409995 1.739095 -2.647613
H -1.548825 2.723545 -3.652307
H -6.152908 1.243152 0.710290
H -5.955324 3.028904 0.532775
H -5.028012 2.145534 1.805559


