%chk=000249215.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249215

0 1
O 2.560834 0.502403 1.118295
O -2.198837 1.838808 0.840096
O 1.494387 -1.491372 1.010771
O 5.303995 -0.550852 -0.514027
N -3.422640 0.121676 -0.000632
C -0.971741 -0.174704 0.342106
C -4.665027 0.943493 0.053062
C -3.541465 -1.249405 -0.554304
C -2.218079 0.688274 0.421732
C 0.249680 0.615563 0.807135
C -5.527579 0.576111 1.258757
C -3.179676 -1.297787 -2.038788
C 1.437814 -0.285275 0.975027
C 3.853218 -0.160687 1.273146
C 4.788222 0.537723 0.290590
C 6.152548 -0.117458 -1.591232
H -0.818583 -0.545113 -0.694470
H -1.092562 -1.089317 0.966350
H -5.230331 0.808156 -0.893873
H -4.372604 2.022331 0.112587
H -4.586473 -1.607480 -0.406110
H -2.895638 -1.947219 0.025791
H 0.478339 1.448200 0.104000
H 0.032014 1.142816 1.768794
H -5.851053 -0.469553 1.238417
H -4.979796 0.729922 2.198775
H -6.425965 1.202783 1.300600
H -3.810628 -0.624517 -2.632243
H -2.139204 -0.999868 -2.218724
H -3.305927 -2.309359 -2.442048
H 4.123763 -0.005774 2.329632
H 3.763598 -1.247240 1.051714
H 4.241080 1.255735 -0.348773
H 5.629929 1.046019 0.789954
H 5.597451 0.514402 -2.290571
H 7.036735 0.397442 -1.205187
H 6.433404 -1.066176 -2.066851


%chk=000249215-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249215

0 1
O 2.647817 0.243443 0.623803
O -2.163906 1.843786 0.671246
O 1.324035 -1.389096 1.625802
O 5.228433 -0.179024 -0.841741
N -3.472457 0.074510 -0.069182
C -1.026677 -0.302799 0.304574
C -4.671194 0.949514 -0.062200
C -3.667006 -1.341051 -0.454977
C -2.254824 0.623071 0.311751
C 0.275093 0.507582 0.425266
C -5.405713 0.936923 1.295477
C -3.611845 -1.570749 -1.982798
C 1.420333 -0.332177 0.955657
C 3.858874 -0.464929 1.124228
C 5.072833 0.243146 0.550270
C 6.305081 0.538167 -1.519810
H -1.006590 -0.929622 -0.605267
H -1.087029 -1.001491 1.163299
H -5.344534 0.614432 -0.873825
H -4.335375 1.975319 -0.289066
H -4.652487 -1.663020 -0.067273
H -2.914988 -1.969486 0.050848
H 0.570709 0.965398 -0.533606
H 0.097125 1.355793 1.116121
H -5.733075 -0.082378 1.572660
H -4.739866 1.319954 2.087085
H -6.301939 1.583055 1.253220
H -4.367476 -0.955586 -2.503537
H -2.620054 -1.304252 -2.389245
H -3.809709 -2.631999 -2.221428
H 3.855222 -0.429943 2.229231
H 3.825835 -1.519786 0.801196
H 4.939526 1.344881 0.619154
H 5.974722 -0.039463 1.140500
H 6.112968 1.632097 -1.544663
H 7.288885 0.359112 -1.033637
H 6.332457 0.149371 -2.549636


