%chk=000240356.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240356

0 1
N 2.929445 -0.391893 0.080796
N -2.928236 -0.387241 -0.077642
N 1.631019 -0.468962 0.552227
N -1.629904 -0.464230 -0.549318
N 0.859393 -1.473740 -1.551912
N -0.859790 -1.478684 1.550741
C 7.924444 0.505826 -0.160673
C -7.921095 0.520863 0.169087
C 5.210166 0.224356 0.530211
C -5.207942 0.234947 -0.524647
C 7.396395 1.203632 0.939265
C -7.394089 1.214398 -0.934031
C 7.084916 -0.331480 -0.911945
C -7.082003 -0.317407 0.919797
C 6.053103 1.062610 1.283010
C -6.051181 1.071820 -1.278662
C 5.739256 -0.470669 -0.570284
C -5.736780 -0.458235 0.577165
C 9.361449 0.667529 -0.534679
C -9.364382 0.661934 0.526908
C 3.795379 0.098372 0.929348
C -3.793245 0.108640 -0.923902
C 0.707509 -0.923971 -0.281401
C -0.707092 -0.924049 0.282454
H 8.038039 1.857927 1.525911
H -8.036470 1.865745 -1.523141
H 7.482367 -0.875538 -1.766438
H -7.479747 -0.861727 1.773990
H 5.656355 1.609894 2.137721
H -5.654946 1.616944 -2.134994
H 5.090734 -1.122736 -1.158781
H -5.088311 -1.110008 1.166062
H 9.767982 -0.224749 -1.029453
H 9.487946 1.510008 -1.231574
H 9.999831 0.869200 0.335922
H -9.545179 0.516698 1.600461
H -9.764799 1.650863 0.266345
H -9.971172 -0.084745 -0.007487
H 3.557231 0.443655 1.949576
H -3.554188 0.458547 -1.942353
H 0.051700 -1.507878 -2.163051
H 1.743969 -1.325417 -2.023635
H -0.052141 -1.516504 2.161731
H -1.744136 -1.330944 2.023076


%chk=000240356-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240356

0 1
N 2.961720 0.040506 0.067279
N -2.961638 0.046877 -0.067208
N 1.674506 0.022027 0.666822
N -1.674404 0.065250 -0.666725
N 0.861331 0.094618 -1.609182
N -0.861209 -0.007074 1.609282
C 8.136875 0.040797 -0.148451
C -8.136803 0.046516 0.148528
C 5.353546 0.024179 0.550901
C -5.353474 0.063310 -0.550819
C 7.727863 -0.000623 1.208305
C -7.727790 0.088261 -1.208217
C 7.125778 0.072346 -1.151342
C -7.125707 0.014724 1.151412
C 6.360342 -0.008293 1.554639
C -6.360269 0.096019 -1.554550
C 5.762232 0.064801 -0.814823
C -5.762160 0.022359 0.814896
C 9.605634 0.058818 -0.530644
C -9.605566 0.028476 0.530712
C 3.943946 0.013016 0.948906
C -3.943874 0.074563 -0.948822
C 0.700960 0.051531 -0.254832
C -0.700849 0.035842 0.254926
H 8.487584 -0.027253 1.998530
H -8.487512 0.115062 -1.998437
H 7.423263 0.102886 -2.207181
H -7.423193 -0.016093 2.207242
H 6.065291 -0.041105 2.611078
H -6.065218 0.129075 -2.610982
H 4.990617 0.088492 -1.590970
H -4.990545 -0.001522 1.591036
H 9.845898 -0.751526 -1.244130
H 9.879736 1.012565 -1.021161
H 10.256524 -0.062911 0.352023
H -9.845853 0.838909 1.244091
H -10.256446 0.150094 -0.351978
H -9.879658 -0.925215 1.021337
H 3.713706 -0.020396 2.029408
H -3.713639 0.108205 -2.029317
H 0.019476 0.113281 -2.186751
H 1.811451 0.105484 -1.976829
H -0.019349 -0.025396 2.186855
H -1.811324 -0.017880 1.976941


