%chk=000216986.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216986

0 1
N -0.386010 -2.085461 -0.118813
N -2.334608 -0.901815 -0.068092
C -0.929254 -0.761975 -0.047823
C 1.325261 -0.635674 -0.052426
C 0.125773 0.147441 -0.011356
C 1.006837 -2.005420 -0.118642
C -1.441385 -3.018646 -0.180865
C -2.619158 -2.296888 -0.148320
C 2.681175 -0.089451 -0.029711
C -3.296121 0.148493 0.017699
C 2.992626 1.068173 -0.763925
C 3.689263 -0.713705 0.725040
C -2.929098 1.388548 0.574368
C -4.605827 -0.064559 -0.454663
C 5.291620 0.965465 0.011189
C 4.286092 1.589985 -0.744236
C 4.982688 -0.190866 0.744923
C -3.877964 2.408637 0.650386
C -5.539057 0.969423 -0.362226
C -5.181968 2.205094 0.186502
C 6.680955 1.516873 0.020502
H 0.073006 1.212434 0.039833
H 1.650193 -2.858298 -0.175817
H -1.284572 -4.079569 -0.239520
H -3.630947 -2.664443 -0.163951
H 2.218587 1.554563 -1.356633
H 3.456102 -1.605966 1.304192
H -1.919103 1.551342 0.951230
H -4.891887 -1.014514 -0.899599
H 4.515013 2.484436 -1.319368
H 5.753568 -0.682983 1.333727
H -3.597554 3.371205 1.079481
H -6.554194 0.809769 -0.726499
H -5.915388 3.005848 0.251824
H 7.277897 1.075707 -0.791379
H 6.697475 2.605725 -0.118960
H 7.206165 1.306473 0.961328


%chk=000216986-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216986

0 1
N -0.421533 -2.080127 0.045716
N -2.362586 -0.918442 -0.003408
C -0.958181 -0.773835 0.030728
C 1.318261 -0.637321 0.025280
C 0.096138 0.147691 0.009231
C 0.971861 -2.007871 0.048185
C -1.468388 -3.021269 0.017921
C -2.651324 -2.308925 -0.013882
C 2.690766 -0.094156 0.016844
C -3.322021 0.131386 -0.010229
C 2.953365 1.239615 -0.402475
C 3.803710 -0.879507 0.429736
C -2.969411 1.426060 0.453555
C -4.641887 -0.106845 -0.478520
C 5.372558 0.971477 -0.007228
C 4.263670 1.760073 -0.408600
C 5.113046 -0.358946 0.413639
C -3.927306 2.460973 0.448368
C -5.591911 0.934204 -0.469784
C -5.243709 2.225827 -0.009781
C 6.787414 1.522946 -0.047775
H 0.032299 1.231719 0.004348
H 1.592783 -2.898440 0.018016
H -1.305745 -4.093586 0.037382
H -3.669479 -2.681954 0.009984
H 2.124897 1.871184 -0.742561
H 3.637535 -1.900798 0.791901
H -1.967043 1.612095 0.846946
H -4.920971 -1.088335 -0.874567
H 4.431180 2.793591 -0.736961
H 5.947718 -0.990091 0.743830
H -3.643186 3.453656 0.814711
H -6.605118 0.737812 -0.837482
H -5.983644 3.032700 -0.011034
H 7.262802 1.334478 -1.030645
H 6.801845 2.614943 0.117896
H 7.427794 1.053418 0.720113


