%chk=000277327.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277327

0 1
O -3.017944 -0.905910 -1.224820
N -4.196690 0.585116 0.027028
C 2.030548 -0.219832 -0.283744
C 3.318865 0.400049 0.273694
C 0.785615 0.517526 0.228407
C 4.562707 -0.338667 -0.238714
C -0.496196 -0.107413 -0.332959
C 5.851788 0.280401 0.317626
C 7.096597 -0.457490 -0.195200
C -1.746787 0.622010 0.175263
C 8.383047 0.153887 0.355603
C -3.000258 0.002411 -0.411976
C -5.507897 0.054737 -0.415033
C -6.249955 -0.589117 0.725010
C -7.564716 -0.473655 0.893593
H 2.051097 -0.199847 -1.390886
H 1.975892 -1.290166 -0.004812
H 3.299114 0.379398 1.380342
H 3.374873 1.469390 -0.007259
H 0.766163 0.495921 1.335036
H 0.841603 1.586829 -0.052955
H 4.582759 -0.318807 -1.345536
H 4.507275 -1.408292 0.041702
H -0.483733 -0.092437 -1.442551
H -0.556512 -1.181388 -0.062673
H 5.833886 0.260202 1.424173
H 5.908799 1.349874 0.038019
H 7.041747 -1.527659 0.085109
H 7.117102 -0.436135 -1.302443
H -1.779950 0.587166 1.282543
H -1.694120 1.696220 -0.097375
H 8.412935 0.112981 1.450307
H 9.265347 -0.378557 -0.016722
H 8.487266 1.205206 0.064336
H -4.220912 1.293293 0.749044
H -5.341997 -0.707584 -1.223874
H -6.090754 0.883401 -0.877749
H -5.629881 -1.185501 1.397804
H -8.101510 -0.959664 1.696443
H -8.210313 0.103703 0.247499


%chk=000277327-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277327

0 1
O -3.185562 -0.163455 -1.903074
N -4.220070 0.500546 0.072580
C 1.961093 -0.134431 -0.300379
C 3.297526 0.519557 0.116791
C 0.734420 0.777497 -0.072531
C 4.523317 -0.389970 -0.125307
C -0.597769 0.100400 -0.461050
C 5.858163 0.243375 0.327159
C 7.082505 -0.666737 0.076873
C -1.821875 1.017541 -0.230382
C 8.410734 -0.036180 0.547959
C -3.117020 0.397499 -0.765952
C -5.549046 -0.025526 -0.294481
C -6.069607 -1.008792 0.733882
C -7.258159 -0.887394 1.376776
H 2.009342 -0.419708 -1.371847
H 1.824821 -1.079649 0.265928
H 3.251452 0.793006 1.192089
H 3.431241 1.470914 -0.439833
H 0.701130 1.084966 0.994328
H 0.857361 1.710668 -0.661836
H 4.584193 -0.642357 -1.204772
H 4.375803 -1.351894 0.409588
H -0.583292 -0.192608 -1.527505
H -0.722909 -0.835283 0.120511
H 5.800737 0.488114 1.408781
H 6.006369 1.208603 -0.201470
H 6.927152 -1.634909 0.595766
H 7.145813 -0.901844 -1.005352
H -1.916811 1.274250 0.843584
H -1.659613 1.969342 -0.776020
H 8.383608 0.179529 1.632969
H 9.268922 -0.707049 0.358257
H 8.605303 0.918106 0.022523
H -4.111614 0.941506 0.987532
H -5.406919 -0.515867 -1.276855
H -6.270504 0.803854 -0.429935
H -5.416325 -1.869623 0.938497
H -7.601673 -1.636670 2.098291
H -7.927337 -0.037728 1.189215


