%chk=000268977.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268977

0 1
O 2.381066 1.923604 0.384865
O -2.983614 0.868801 -0.311066
O -2.077152 -2.064431 0.132742
N 1.728393 -0.658774 -0.014151
C 0.675739 0.273429 0.039140
C -0.684416 -0.133120 -0.055794
C 1.026828 1.636931 0.202194
C -1.646911 0.908622 -0.082599
C 1.473960 -2.033041 -0.156814
C -0.964106 -1.590358 -0.034172
C 0.193617 -2.475708 -0.189069
C 0.046035 2.626532 0.280820
C -1.282684 2.266105 0.127846
C 2.680061 -2.905356 -0.253534
C 2.983121 2.615526 -0.741745
C -3.674521 -0.307679 -0.802237
H 2.681513 -0.302084 0.102659
H -0.049101 -3.531726 -0.293681
H 0.333407 3.664692 0.450401
H -2.076283 3.012338 0.155557
H 2.403904 -3.959597 -0.420758
H 3.278590 -2.883995 0.670579
H 3.338669 -2.618660 -1.086793
H 2.513063 3.592973 -0.878485
H 2.902749 2.010307 -1.647520
H 4.024180 2.724070 -0.417962
H -3.113292 -0.792969 -1.603195
H -4.611924 0.130100 -1.164282
H -3.840892 -1.000534 0.036454


%chk=000268977-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268977

0 1
O 2.502362 1.673326 -0.383204
O -3.028416 0.658849 0.123142
O -2.144732 -2.170543 0.405926
N 1.724309 -0.826431 -0.195570
C 0.704923 0.128866 -0.166805
C -0.669410 -0.255659 -0.033407
C 1.106329 1.495737 -0.255240
C -1.643634 0.811265 -0.025945
C 1.481968 -2.183350 -0.059146
C -0.969423 -1.708948 0.175081
C 0.180865 -2.613320 0.121532
C 0.143716 2.510431 -0.200837
C -1.222365 2.155042 -0.094377
C 2.686818 -3.093147 -0.112757
C 2.996539 3.047464 -0.477568
C -3.774247 -0.150453 -0.866111
H 2.675487 -0.463027 -0.300519
H -0.031447 -3.677405 0.249997
H 0.424992 3.566014 -0.254403
H -1.997921 2.925521 -0.068413
H 2.380753 -4.141860 0.019548
H 3.414122 -2.846221 0.684132
H 3.210939 -3.009504 -1.083940
H 2.744988 3.623020 0.433806
H 2.581537 3.557720 -1.367832
H 4.088764 2.960655 -0.573434
H -3.515992 0.172416 -1.893855
H -4.833134 0.069420 -0.659003
H -3.558691 -1.219878 -0.711398


