%chk=000227534.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227534

0 1
N -3.351383 -1.410112 0.012832
N 1.363079 -1.378697 -0.044469
N -1.180694 2.759018 0.298545
N -2.240513 0.684258 0.079870
N 0.241511 0.857979 0.087929
N 0.918933 -2.695808 -0.114796
C -0.914828 -1.340624 -0.029969
C -4.704991 -0.775237 -0.015533
C -2.180936 -0.684587 0.013029
C 0.258749 -0.504373 0.011809
C -0.023476 3.702629 0.234915
C -1.037434 1.395299 0.142373
C -0.424079 -2.688174 -0.106305
C -5.681761 -1.702224 0.714175
C -5.135359 -0.525252 -1.464446
C 2.772800 -1.089078 -0.032163
C -0.401146 4.964504 1.016629
C 0.322734 4.021389 -1.223234
C 3.220849 0.241042 -0.099560
C 3.695282 -2.152187 0.046020
C 4.593879 0.498257 -0.085233
C 5.060735 -1.870819 0.056794
C 5.515881 -0.548833 -0.007863
H -4.640045 0.208963 0.528284
H -3.302922 -2.411413 -0.146390
H 0.858796 3.203674 0.726070
H -2.120197 3.149113 0.233736
H -1.009098 -3.592799 -0.151377
H -6.673195 -1.237902 0.783954
H -5.814044 -2.663072 0.205211
H -5.350113 -1.910942 1.739476
H -4.430224 0.151300 -1.968083
H -6.123106 -0.053585 -1.506312
H -5.184763 -1.446077 -2.053971
H 0.449920 5.654480 1.067454
H -1.231717 5.512344 0.558185
H -0.688475 4.727824 2.049356
H 0.614905 3.108385 -1.762039
H 1.165073 4.718398 -1.286098
H -0.516552 4.467549 -1.765991
H 2.514448 1.073963 -0.159538
H 3.345268 -3.185380 0.095800
H 4.943809 1.528762 -0.135647
H 5.776818 -2.689805 0.116928
H 6.582685 -0.338650 0.002240


%chk=000227534-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227534

0 1
N -3.364334 -1.415370 0.036268
N 1.353650 -1.372001 -0.013078
N -1.183497 2.719976 0.196008
N -2.239937 0.651299 0.090140
N 0.226175 0.837979 0.077173
N 0.952113 -2.732119 -0.051423
C -0.909367 -1.372816 0.014012
C -4.706030 -0.787651 0.046767
C -2.185563 -0.708460 0.043174
C 0.243076 -0.525548 0.030415
C -0.058595 3.676617 0.217713
C -1.044970 1.354101 0.116747
C -0.401717 -2.709772 -0.034253
C -5.717285 -1.778248 0.656904
C -5.120098 -0.328387 -1.371826
C 2.752467 -1.067698 -0.024045
C -0.526958 4.983493 0.888359
C 0.503937 3.922326 -1.203779
C 3.198670 0.278681 0.000325
C 3.688157 -2.132925 -0.061131
C 4.584354 0.546446 -0.012914
C 5.067914 -1.844202 -0.073749
C 5.526994 -0.506036 -0.049927
H -4.624399 0.108314 0.688494
H -3.311965 -2.431592 -0.040176
H 0.739686 3.214053 0.828024
H -2.144218 3.065229 0.193563
H -0.935296 -3.659762 -0.057111
H -6.721610 -1.321828 0.694666
H -5.794631 -2.698215 0.044194
H -5.428676 -2.064023 1.684204
H -4.368418 0.369464 -1.777629
H -6.096012 0.190602 -1.340125
H -5.209674 -1.192451 -2.056336
H 0.305855 5.706417 0.935591
H -1.345592 5.456069 0.310707
H -0.885071 4.798948 1.916987
H 0.818027 2.967037 -1.657543
H 1.381626 4.593838 -1.162235
H -0.259898 4.389138 -1.853095
H 2.462277 1.085035 0.029121
H 3.319876 -3.160786 -0.079622
H 4.926132 1.587658 0.005703
H 5.787246 -2.670413 -0.102522
H 6.600683 -0.288918 -0.060145


