%chk=000296102.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296102

0 1
O -1.670302 -2.642055 0.514221
O -3.264164 -1.025841 0.781366
O 3.845450 0.917465 1.122102
N -1.091014 -0.486107 0.058767
N 2.625421 -0.840854 0.269805
N 0.326233 -1.566428 -2.874125
C 0.228464 -1.080862 -0.291244
C -1.265953 0.943685 -0.042941
C 1.385478 -0.158534 0.097145
C -0.113174 1.764225 0.046228
C 1.202147 1.168676 0.243848
C -2.537600 1.511745 -0.216760
C -0.266006 3.156753 -0.053020
C -2.133496 -1.331521 0.482542
C -2.659199 2.898445 -0.311280
C -1.529108 3.720562 -0.232659
C 0.281816 -1.346995 -1.742979
C 3.809651 -0.243510 0.774612
C 4.977088 -1.185594 0.834417
C -2.652643 -3.624884 0.951631
H 0.323532 -2.073854 0.258633
H 2.024897 1.839787 0.525875
H -3.430984 0.881891 -0.267420
H 0.613971 3.798015 0.012907
H 2.658020 -1.811189 -0.042644
H -3.646016 3.341474 -0.448444
H -1.636358 4.801359 -0.309589
H 5.855073 -0.662388 1.253747
H 5.275065 -1.553269 -0.157204
H 4.790937 -2.054690 1.479383
H -2.094697 -4.562813 0.856751
H -3.524252 -3.595843 0.288632
H -2.941776 -3.416749 1.986896


%chk=000296102-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296102

0 1
O -1.622100 -2.667427 0.560134
O -3.243294 -1.017068 0.911379
O 4.012679 0.953607 0.918314
N -1.085445 -0.471883 0.094074
N 2.604317 -0.826625 0.344996
N 0.398132 -1.464125 -2.944662
C 0.232852 -1.028398 -0.295310
C -1.294424 0.949860 -0.057758
C 1.384034 -0.131293 0.168333
C -0.140402 1.787965 0.054158
C 1.178123 1.213011 0.309461
C -2.569785 1.512381 -0.288345
C -0.306435 3.193184 -0.061475
C -2.087024 -1.336731 0.550952
C -2.704233 2.913493 -0.406373
C -1.575553 3.758067 -0.291655
C 0.315655 -1.266409 -1.771249
C 3.848958 -0.279382 0.692137
C 4.990623 -1.286755 0.777455
C -2.612469 -3.657353 1.041631
H 0.305811 -2.019785 0.187683
H 2.007786 1.861487 0.597937
H -3.448984 0.870137 -0.350828
H 0.577597 3.834532 0.029868
H 2.585479 -1.835227 0.178613
H -3.696005 3.340836 -0.588253
H -1.686706 4.843596 -0.380932
H 5.429523 -1.248380 1.789266
H 5.782555 -0.991122 0.067874
H 4.690789 -2.326424 0.558763
H -2.095490 -4.624395 0.967748
H -3.510240 -3.637048 0.402470
H -2.899824 -3.436223 2.082792


