%chk=000257895.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257895

0 1
O 5.248252 2.647015 0.521798
O -5.118309 2.815169 -0.486585
O 5.865754 1.397469 -1.132268
O -5.835457 1.494585 1.069068
N 5.102561 1.694141 -0.226772
N -5.032129 1.814756 0.207286
C 0.460019 -1.650875 0.584891
C -0.488661 -1.652201 -0.655686
C 0.822447 -3.129017 0.856915
C -0.893396 -3.125619 -0.905909
C -0.315361 -3.961188 0.247349
C 1.676520 -0.785463 0.362463
C -1.681372 -0.754311 -0.423933
C 1.891635 0.331675 1.187735
C -1.828021 0.416284 -1.187323
C 2.596624 -1.078567 -0.660534
C -2.643839 -1.071556 0.551887
C 3.007989 1.145363 1.001042
C -2.919820 1.259582 -0.986384
C 3.715961 -0.274291 -0.857501
C -3.739043 -0.238306 0.762166
C 3.916745 0.837446 -0.023046
C -3.872087 0.927077 -0.010746
H -0.106618 -1.268832 1.471463
H 0.073299 -1.289510 -1.551428
H 1.790236 -3.400225 0.397954
H 0.936769 -3.317767 1.937274
H -1.987270 -3.248480 -0.983010
H -0.486084 -3.465671 -1.874938
H -1.092317 -4.173335 1.003668
H 0.044878 -4.942755 -0.104308
H 1.183328 0.570519 1.982290
H -1.085764 0.674141 -1.943908
H 2.435233 -1.945074 -1.303803
H -2.532149 -1.979656 1.146609
H 3.183777 2.018002 1.640467
H -3.042884 2.174157 -1.577650
H 4.439239 -0.495595 -1.650391
H -4.495284 -0.477388 1.518197


%chk=000257895-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257895

0 1
O 4.729694 3.033624 0.799626
O -4.587483 3.193648 -0.721710
O 5.463900 1.995046 -1.094434
O -5.406922 2.070885 1.087438
N 4.663920 2.094059 -0.084302
N -4.578235 2.200429 0.104164
C 0.519989 -1.952745 0.523045
C -0.557400 -1.948373 -0.638330
C 1.015131 -3.425653 0.542587
C -1.108601 -3.423245 -0.682453
C -0.288138 -4.236091 0.363206
C 1.601406 -0.898155 0.361826
C -1.613430 -0.870075 -0.452053
C 1.717648 0.167718 1.292308
C -1.671492 0.249934 -1.321977
C 2.517538 -0.948850 -0.725916
C -2.556705 -0.950931 0.610679
C 2.714653 1.153796 1.158119
C -2.636278 1.262207 -1.150640
C 3.520934 0.023840 -0.881149
C -3.528601 0.046605 0.802101
C 3.606990 1.066074 0.068895
C -3.555497 1.144830 -0.086832
H -0.014179 -1.763412 1.475685
H -0.022749 -1.739636 -1.584476
H 1.702842 -3.609815 -0.305190
H 1.561635 -3.667172 1.471214
H -2.192110 -3.461405 -0.476506
H -0.964404 -3.835775 -1.697006
H -0.831937 -4.282575 1.326364
H -0.103427 -5.275725 0.041060
H 1.015930 0.224062 2.132144
H -0.950716 0.328421 -2.143758
H 2.451176 -1.761083 -1.458773
H -2.534792 -1.809327 1.292555
H 2.813120 1.977826 1.869559
H -2.690713 2.128337 -1.815281
H 4.233306 -0.005195 -1.709830
H -4.260600 -0.004403 1.612441


