%chk=000194152.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194152

0 1
O -2.771622 -2.588071 0.000853
O -4.557697 1.649031 -0.001038
N 0.099260 1.339727 -0.001538
N -0.166047 -1.492689 -0.000027
N -3.675078 -0.479829 0.000099
N -2.255264 1.514771 -0.001086
C 1.274250 0.542923 -0.000394
C 2.622056 1.038630 0.000629
C 1.085333 -0.875279 -0.000193
C 3.696543 0.138984 0.000378
C 3.483340 -1.275428 0.000066
C -1.174950 0.742416 -0.000828
C 2.193891 -1.761392 -0.000015
C -1.228674 -0.737150 -0.000059
C 2.918935 2.505767 0.002492
C 0.132697 2.824871 -0.004029
C 5.103740 0.650821 0.000636
C -2.591486 -1.392513 0.000389
C 4.622845 -2.243257 0.000114
C -3.559834 0.970410 -0.000512
C -5.056652 -1.035691 0.000511
H 1.986011 -2.837437 0.000037
H 2.509019 2.997824 0.898365
H 3.991505 2.742491 0.005539
H 2.513618 2.999250 -0.894682
H 0.634055 3.202676 -0.911804
H 0.629413 3.205851 0.904979
H -0.895791 3.257287 -0.007349
H 5.304870 1.265003 0.892203
H 5.863807 -0.141037 -0.002840
H 5.303234 1.270987 -0.887141
H 4.284552 -3.289745 0.000306
H 5.257745 -2.119246 -0.889552
H 5.257911 -2.118979 0.889622
H -5.602597 -0.690906 0.895479
H -5.033536 -2.140543 -0.001017
H -5.604101 -0.688425 -0.892591


%chk=000194152-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194152

0 1
O -2.756509 -2.634833 0.004320
O -4.607261 1.663210 -0.005938
N 0.081606 1.344655 -0.002050
N -0.167970 -1.492229 0.001730
N -3.687667 -0.479749 0.002146
N -2.278017 1.515925 -0.001364
C 1.269991 0.563324 0.000349
C 2.622312 1.068147 0.002288
C 1.077266 -0.874382 0.000606
C 3.711865 0.140832 0.000489
C 3.500725 -1.283536 -0.001135
C -1.198887 0.734850 -0.000180
C 2.188200 -1.754810 -0.000184
C -1.249541 -0.723870 0.002343
C 2.975119 2.555712 0.008217
C 0.051808 2.834844 -0.009833
C 5.147822 0.650209 0.000649
C -2.599602 -1.383756 0.003410
C 4.645991 -2.281689 -0.002841
C -3.561656 0.958617 0.001716
C -5.063611 -1.025651 0.001262
H 1.956776 -2.823766 -0.000256
H 2.586212 3.076276 0.898481
H 4.062344 2.700513 0.015410
H 2.597077 3.081560 -0.883686
H 0.536918 3.228948 -0.913739
H 0.529557 3.239005 0.893509
H -1.012335 3.115646 -0.015173
H 5.365021 1.265743 0.893497
H 5.869413 -0.177947 -0.004605
H 5.362003 1.274600 -0.886696
H 4.256434 -3.312659 -0.002840
H 5.291456 -2.171041 -0.894182
H 5.293552 -2.171788 0.887054
H -5.606428 -0.673771 0.893665
H -4.988910 -2.122527 0.000586
H -5.605772 -0.672509 -0.891022


