%chk=000257729.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257729

0 1
N 1.428039 0.896641 -0.578405
N 3.245114 1.810664 0.497262
N 2.274051 -1.457896 -0.802297
N 4.523237 -1.730795 0.131788
N 5.726214 0.030404 1.150711
N -8.276694 -0.344686 -0.034072
C -0.963210 0.508879 -0.046013
C -2.374663 0.422859 -0.637338
C 0.073612 0.779392 -1.148292
C -3.413101 0.126588 0.453343
C -4.826827 0.053357 -0.135275
C 2.350335 -0.138803 -0.417861
C 2.021493 2.058499 0.012353
C 3.484501 0.451465 0.247666
C -5.864819 -0.256190 0.956379
C 4.594117 -0.408543 0.516828
C 3.385152 -2.174796 -0.496537
C -7.208156 -0.305836 0.404252
H -0.917148 1.299147 0.728318
H -0.709139 -0.437418 0.476918
H -2.630177 1.368661 -1.154179
H -2.411442 -0.367645 -1.413992
H -0.166463 1.713275 -1.704081
H 0.074212 -0.057166 -1.891551
H -3.368340 0.906542 1.238705
H -3.162585 -0.826896 0.959843
H -4.871948 -0.722781 -0.926072
H -5.082456 1.008582 -0.636635
H 1.510212 3.010260 0.030882
H -5.626830 -1.226898 1.452327
H -5.819645 0.512395 1.763636
H 3.385797 -3.241524 -0.780914
H 6.501229 -0.593036 1.311967
H 5.813529 0.996802 1.424237


%chk=000257729-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257729

0 1
N 1.498862 1.072744 -0.611146
N 3.487453 1.879353 0.218858
N 1.973049 -1.366591 -0.494674
N 4.225396 -1.822592 0.390856
N 5.722147 -0.115492 1.048419
N -8.322257 -0.560350 -0.003986
C -0.902868 0.589019 -0.063908
C -2.339440 0.541767 -0.628646
C 0.119937 1.040069 -1.130566
C -3.368690 0.053046 0.415301
C -4.807109 0.009532 -0.144342
C 2.286587 -0.047575 -0.324776
C 2.268918 2.193341 -0.261974
C 3.509519 0.472300 0.182285
C -5.821422 -0.497227 0.919624
C 4.502552 -0.484289 0.547566
C 3.002639 -2.180638 -0.111627
C -7.206423 -0.536488 0.418926
H -0.858136 1.278750 0.802095
H -0.608373 -0.413787 0.298543
H -2.634613 1.548474 -0.991628
H -2.366738 -0.131565 -1.510177
H -0.124661 2.050670 -1.506598
H 0.094837 0.340836 -1.986572
H -3.335693 0.718272 1.303041
H -3.076273 -0.957225 0.768195
H -4.848031 -0.653043 -1.029842
H -5.111076 1.017668 -0.485173
H 1.892464 3.207202 -0.385047
H -5.538470 -1.513539 1.256181
H -5.788310 0.156057 1.813298
H 2.831914 -3.256294 -0.217023
H 6.395279 -0.839394 1.290887
H 5.944231 0.870494 1.167531


