%chk=000268497.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268497

0 1
O 4.527387 0.766175 0.251274
O 2.473875 -2.943131 0.958137
O 2.298376 1.598291 1.428153
O -1.018831 0.338409 -1.376444
N 1.174926 1.805228 -0.559926
C 3.015090 -1.020693 -0.499895
C 3.317052 0.511922 -0.455488
C 2.689280 -1.527502 0.929601
C 4.267965 -1.737183 -1.017092
C 1.831227 -1.281259 -1.438719
C 2.208894 1.327346 0.237379
C 0.040693 2.526057 0.062484
C -1.006989 1.575542 0.666391
C -1.592969 0.610108 -0.337705
C -2.911862 -0.006374 -0.006313
C -3.337412 -0.196388 1.316644
C -3.730969 -0.422657 -1.068473
C -4.576814 -0.787728 1.572355
C -4.973474 -1.006241 -0.809252
C -5.396735 -1.188411 0.510989
H 3.543307 0.892287 -1.479699
H 1.806546 -1.024202 1.360828
H 3.553267 -1.400945 1.611083
H 4.413828 -1.599055 -2.091658
H 4.211258 -2.815556 -0.815503
H 5.171505 -1.360259 -0.513448
H 1.676216 -2.358586 -1.582507
H 2.000885 -0.865021 -2.438467
H 0.882778 -0.869837 -1.069185
H 0.954213 1.350696 -1.453925
H 4.352098 0.839674 1.228444
H -0.423303 3.171026 -0.717111
H 0.433420 3.195270 0.867350
H 1.751146 -3.189844 0.345815
H -1.805044 2.176434 1.149516
H -0.537376 0.995116 1.494781
H -2.704823 0.103588 2.151941
H -3.384147 -0.290455 -2.096995
H -4.905154 -0.938726 2.600143
H -5.608697 -1.323129 -1.635690
H -6.365134 -1.646085 0.714785


%chk=000268497-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268497

0 1
O 4.665118 0.725644 0.144006
O 2.749252 -3.053074 1.038846
O 2.614287 1.744450 1.465699
O -1.331947 0.948448 -1.559888
N 1.156653 1.640278 -0.345216
C 3.076860 -1.080801 -0.500295
C 3.368957 0.467402 -0.476860
C 3.057771 -1.614790 0.961464
C 4.227647 -1.762095 -1.284292
C 1.728698 -1.387660 -1.201544
C 2.328094 1.325604 0.290505
C 0.114119 2.471789 0.276616
C -1.100856 1.651577 0.757932
C -1.812227 0.914826 -0.382865
C -3.069941 0.154543 -0.091932
C -3.615869 0.061407 1.218112
C -3.732441 -0.499236 -1.168042
C -4.799589 -0.671778 1.445365
C -4.914992 -1.228708 -0.939947
C -5.451544 -1.316902 0.368185
H 3.424150 0.814747 -1.528858
H 2.343873 -1.030498 1.580469
H 4.062497 -1.522979 1.402395
H 4.161459 -1.536578 -2.365850
H 4.170339 -2.856816 -1.148801
H 5.203859 -1.407142 -0.913657
H 1.654786 -2.468749 -1.419520
H 1.655984 -0.868559 -2.176540
H 0.851625 -1.095893 -0.593502
H 0.935044 1.257308 -1.267784
H 4.458661 1.158384 1.024803
H -0.216052 3.226375 -0.459732
H 0.577648 2.987681 1.133826
H 1.797218 -3.190511 0.803985
H -1.820777 2.327052 1.261930
H -0.778731 0.917305 1.522984
H -3.121818 0.553849 2.062144
H -3.297084 -0.416993 -2.169424
H -5.213772 -0.741790 2.456791
H -5.420221 -1.728195 -1.773489
H -6.371240 -1.885025 0.546581


