%chk=000257038.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257038

0 1
O 0.071222 -0.835206 -1.754270
O -1.319873 1.356833 2.220712
O 1.010408 -0.398908 2.757844
N 0.813133 -0.839711 0.461087
C -1.214036 0.399685 -0.046572
C -1.251947 1.737925 -0.815780
C -0.079029 -0.488684 -0.612862
C -2.567929 -0.279986 -0.147828
C -0.808361 0.635536 1.420744
C 0.452199 -0.238615 1.711353
C 0.051237 2.488706 -0.757751
C -2.834298 -1.195913 -1.176060
C -3.584235 0.048484 0.763302
C 1.975081 -1.691248 0.291075
C 0.285767 3.415083 0.269079
C 1.032671 2.270578 -1.736014
C -4.091885 -1.798314 -1.270814
C -4.839276 -0.556529 0.663738
C 2.409795 -2.488265 1.363875
C 2.653046 -1.710383 -0.939498
C -5.095730 -1.484780 -0.350145
C 1.493022 4.117228 0.314422
C 2.237864 2.975764 -1.686166
C 2.470293 3.899650 -0.662152
C 3.529588 -3.305058 1.194175
C 3.767201 -2.538831 -1.089104
C 4.208849 -3.335273 -0.027873
H -2.079902 2.360793 -0.409849
H -1.536809 1.533025 -1.872628
H -2.068972 -1.443474 -1.917624
H -3.407508 0.782091 1.554132
H -0.471072 3.588404 1.034795
H 0.857758 1.547815 -2.534265
H -4.287508 -2.514068 -2.069151
H -5.620154 -0.300801 1.379653
H 1.894083 -2.462943 2.325727
H 2.310862 -1.098896 -1.776465
H -6.073666 -1.958034 -0.424041
H 1.672394 4.834865 1.114330
H 2.998055 2.803939 -2.447172
H 3.410301 4.447384 -0.624520
H 3.873364 -3.922314 2.024279
H 4.294329 -2.561035 -2.042808
H 5.079268 -3.976418 -0.152309


%chk=000257038-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257038

0 1
O 0.192946 -0.740785 -1.791044
O -1.199781 1.410527 2.263528
O 0.961426 -0.574836 2.857133
N 0.842493 -0.892463 0.486376
C -1.137404 0.418738 -0.029048
C -1.247654 1.786725 -0.802985
C 0.004350 -0.449124 -0.589193
C -2.503006 -0.323762 -0.101577
C -0.721014 0.609674 1.435346
C 0.446495 -0.345018 1.744230
C 0.026401 2.621684 -0.814225
C -2.752555 -1.319567 -1.080557
C -3.551056 0.062321 0.774679
C 1.963667 -1.788228 0.321741
C 0.288498 3.560896 0.218069
C 0.971924 2.483399 -1.864734
C -4.025932 -1.925502 -1.169250
C -4.821559 -0.546063 0.679791
C 2.171358 -2.818642 1.270936
C 2.844995 -1.627716 -0.775273
C -5.064555 -1.544487 -0.290682
C 1.469141 4.336523 0.205118
C 2.152104 3.260084 -1.880087
C 2.406047 4.188114 -0.843562
C 3.267509 -3.692580 1.115068
C 3.933602 -2.513048 -0.921188
C 4.149693 -3.546085 0.020083
H -2.074989 2.342674 -0.326334
H -1.558771 1.534711 -1.832618
H -1.965111 -1.613546 -1.780663
H -3.375755 0.831688 1.534154
H -0.435713 3.685647 1.031884
H 0.776621 1.768717 -2.673374
H -4.204533 -2.693681 -1.929799
H -5.618923 -0.240212 1.365988
H 1.494146 -2.929473 2.121118
H 2.678111 -0.828249 -1.500536
H -6.050030 -2.017755 -0.361758
H 1.655025 5.057166 1.009209
H 2.868013 3.146826 -2.702099
H 3.320001 4.792433 -0.855991
H 3.429925 -4.487849 1.850108
H 4.614985 -2.391449 -1.769874
H 4.998464 -4.228325 -0.097507


