%chk=000246811.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246811

0 1
O 3.587304 1.884490 -0.075130
N 4.908745 0.219850 0.736990
C 6.124078 0.999112 0.355573
C 5.177395 -1.236856 0.861207
C 6.755690 0.462949 -0.940175
C 5.769760 -1.814908 -0.436987
C 7.032167 -1.043605 -0.847869
C -0.087888 -0.262938 0.367828
C -1.371148 0.524151 0.068441
C 1.152913 0.622448 0.208954
C 2.441299 -0.156070 0.506375
C -2.618831 -0.355402 0.224828
C 3.656777 0.731003 0.321295
C -3.900816 0.433479 -0.074501
C -5.149612 -0.444836 0.081241
C -6.431268 0.344462 -0.218334
C -7.680149 -0.533405 -0.062675
C -8.962850 0.255200 -0.362292
C -10.209429 -0.613493 -0.208565
H 5.841489 2.072283 0.234396
H 6.843138 0.940186 1.200235
H 5.898338 -1.371597 1.701250
H 4.258515 -1.783833 1.152262
H 6.080502 0.672010 -1.793854
H 7.691330 1.012309 -1.152507
H 6.004193 -2.886147 -0.298223
H 5.020018 -1.766003 -1.249838
H 7.842576 -1.232920 -0.117751
H 7.402831 -1.418660 -1.820377
H -0.019109 -1.137908 -0.306667
H -0.131644 -0.674178 1.394706
H -1.440741 1.400522 0.741958
H -1.327853 0.938368 -0.957694
H 1.090380 1.505130 0.877818
H 1.202796 1.045390 -0.815479
H 2.513777 -1.036547 -0.163347
H 2.411087 -0.551046 1.542486
H -2.549938 -1.230427 -0.449704
H -2.662590 -0.768027 1.251144
H -3.969966 1.308960 0.599736
H -3.857198 0.847242 -1.100507
H -5.080828 -1.320021 -0.593153
H -5.193726 -0.857846 1.107403
H -6.500084 1.219835 0.455951
H -6.387217 0.757825 -1.244412
H -7.725745 -0.947053 0.963001
H -7.612841 -1.409065 -0.736367
H -8.919469 0.667888 -1.389223
H -9.032282 1.130870 0.312378
H -11.119149 -0.042175 -0.424161
H -10.190665 -1.470589 -0.891198
H -10.303263 -1.008006 0.809536


%chk=000246811-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246811

0 1
O 3.588928 2.015383 0.026672
N 4.936912 0.158035 0.397765
C 6.164663 0.986786 0.362115
C 5.175210 -1.282516 0.622045
C 7.151847 0.463743 -0.705455
C 6.142396 -1.856379 -0.443123
C 7.455068 -1.038525 -0.489330
C -0.110601 -0.259065 0.176495
C -1.428718 0.513970 -0.053531
C 1.139212 0.643276 0.078874
C 2.447818 -0.144569 0.285569
C -2.691694 -0.363424 0.097622
C 3.691148 0.761564 0.224465
C -4.005375 0.410384 -0.154190
C -5.274739 -0.445621 0.054926
C -6.585161 0.329750 -0.209641
C -7.858340 -0.510576 0.036544
C -9.166766 0.267555 -0.232227
C -10.435097 -0.573609 0.028085
H 5.851199 2.023507 0.159849
H 6.646939 0.955146 1.362823
H 5.624966 -1.420094 1.629904
H 4.220928 -1.829479 0.609942
H 6.710061 0.616414 -1.709376
H 8.084361 1.058272 -0.661029
H 6.351454 -2.918627 -0.211252
H 5.648337 -1.821962 -1.434027
H 7.998203 -1.167350 0.470344
H 8.118861 -1.419996 -1.287747
H -0.036927 -1.082683 -0.565425
H -0.142427 -0.743087 1.176053
H -1.484563 1.360440 0.662394
H -1.414250 0.967126 -1.066730
H 1.081255 1.455123 0.827642
H 1.169412 1.146442 -0.905892
H 2.526646 -0.940051 -0.484107
H 2.417300 -0.665231 1.265283
H -2.630857 -1.221658 -0.604371
H -2.713773 -0.798963 1.118918
H -4.044731 1.291298 0.520670
H -4.000264 0.813539 -1.188646
H -5.233688 -1.334088 -0.609859
H -5.284362 -0.836452 1.094247
H -6.612368 1.231745 0.437523
H -6.586602 0.699919 -1.256474
H -7.859873 -0.875688 1.085236
H -7.833086 -1.415590 -0.606439
H -9.167762 0.625927 -1.282062
H -9.186791 1.175387 0.405109
H -11.355290 0.006748 -0.169522
H -10.455916 -1.470787 -0.619384
H -10.472305 -0.919005 1.078727


