%chk=000258985.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258985

0 1
N -2.267857 0.351565 0.411388
N 0.575748 0.186460 -0.137178
N -4.359898 -1.167177 -1.942501
C -1.640214 1.149494 -0.694745
C -1.522128 -0.944488 0.546928
C -3.750701 0.175494 0.255905
C -0.177651 1.464627 -0.320807
C -0.058729 -0.645431 0.930535
C 1.997203 0.241490 -0.181037
C -4.433833 1.553108 0.176026
C -4.311704 -0.604044 1.459500
C -4.094820 -0.582070 -0.984545
C 2.770984 -0.803827 0.371004
C 2.651559 1.283372 -0.880076
C 4.161578 -0.811522 0.217454
C 4.036955 1.258981 -1.023739
C 4.801849 0.225080 -0.480288
C 4.965053 -1.937062 0.788288
H -2.191234 2.106502 -0.817297
H -1.673416 0.619501 -1.673574
H -1.550852 -1.551584 -0.386200
H -1.985088 -1.553429 1.352753
H 0.287966 2.054224 -1.143976
H -0.146401 2.091410 0.598755
H -0.020883 -0.136283 1.919847
H 0.494824 -1.607848 1.027667
H -4.171765 2.102377 -0.736122
H -5.525994 1.458303 0.194278
H -4.139877 2.176924 1.031781
H -3.958936 -1.641753 1.492247
H -5.407481 -0.635006 1.438864
H -4.010226 -0.124091 2.401105
H 2.288284 -1.620384 0.902164
H 2.080303 2.095045 -1.322613
H 4.531335 2.063543 -1.569202
H 5.879841 0.222391 -0.600095
H 5.016608 -2.772352 0.073809
H 5.997786 -1.640530 1.013861
H 4.532511 -2.330111 1.717236


%chk=000258985-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258985

0 1
N -2.286315 0.330824 0.404064
N 0.573526 0.189093 -0.147921
N -4.378188 -0.842164 -2.130449
C -1.642526 1.249519 -0.578965
C -1.561362 -0.971608 0.378704
C -3.778811 0.221261 0.278715
C -0.166004 1.468420 -0.209794
C -0.077504 -0.784090 0.744635
C 1.988420 0.183909 -0.280353
C -4.437357 1.624783 0.401890
C -4.352318 -0.687628 1.402652
C -4.158323 -0.369127 -1.055680
C 2.807607 -0.698293 0.485587
C 2.634395 1.042549 -1.221002
C 4.212846 -0.750873 0.316415
C 4.032159 1.002439 -1.378639
C 4.828988 0.112881 -0.621200
C 5.042595 -1.733316 1.128184
H -2.145676 2.229315 -0.553230
H -1.709124 0.843838 -1.616691
H -1.628626 -1.450187 -0.627543
H -2.004250 -1.656861 1.119117
H 0.288003 2.132417 -0.961230
H -0.118507 1.988770 0.775053
H -0.001630 -0.473011 1.813598
H 0.418448 -1.764342 0.636525
H -4.218593 2.276178 -0.459120
H -5.533060 1.517369 0.465743
H -4.068035 2.106546 1.323908
H -4.074046 -1.746426 1.279669
H -5.453731 -0.632351 1.400592
H -3.975224 -0.324791 2.374716
H 2.357911 -1.345673 1.245353
H 2.047839 1.717112 -1.852192
H 4.504718 1.667356 -2.111201
H 5.916358 0.090740 -0.756088
H 5.123210 -2.708299 0.608828
H 6.069641 -1.359649 1.285880
H 4.593249 -1.925729 2.118869


