%chk=000228297.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228297

0 1
N 1.025571 -0.328346 0.006742
N 2.377319 1.620778 -0.008466
N 5.711006 -0.795064 0.004731
N 4.823608 1.540731 -0.010777
N 5.171470 -2.060538 0.014377
C -3.985190 -0.437692 0.000639
C -2.730440 0.445641 -0.001335
C -5.264307 0.410391 -0.003542
C -1.451482 -0.402971 0.004903
C -6.520303 -0.471075 -0.001056
C -0.212253 0.498647 0.002439
C -7.800846 0.375882 -0.004492
C -9.054364 -0.496115 -0.003940
C 2.271315 0.242675 0.001377
C 3.457700 -0.551521 0.005652
C 4.705906 0.169953 -0.000928
C 3.826497 -1.940315 0.015050
C 3.628811 2.184111 -0.013820
H -3.977288 -1.108496 -0.880382
H -3.978954 -1.102360 0.886245
H -2.743067 1.118109 0.879227
H -2.740067 1.109694 -0.888314
H -5.273489 1.075042 -0.889147
H -5.274798 1.081893 0.876866
H -1.444532 -1.073310 -0.877742
H -1.447361 -1.064546 0.894165
H -6.514356 -1.136317 0.883741
H -6.513573 -1.142380 -0.881240
H -0.200590 1.167664 -0.891360
H -0.202107 1.174610 0.890969
H -7.811750 1.045787 0.877600
H -7.809746 1.041747 -0.889668
H 0.932986 -1.336853 0.014350
H -9.962805 0.116800 -0.005009
H -9.095999 -1.144739 -0.886335
H -9.096699 -1.142666 0.879941
H 3.167464 -2.793060 0.021859
H 6.711888 -0.655686 0.002577
H 3.654825 3.287895 -0.021997


%chk=000228297-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228297

0 1
N 1.055269 -0.282971 0.006020
N 2.439654 1.619390 -0.010803
N 5.734439 -0.808918 0.006896
N 4.897239 1.513070 -0.012002
N 5.223493 -2.108879 0.017932
C -3.996505 -0.414925 0.000119
C -2.726999 0.465081 -0.000535
C -5.304167 0.408079 -0.002067
C -1.420499 -0.359413 0.002661
C -6.576331 -0.468650 -0.001908
C -0.170427 0.539303 0.001009
C -7.884610 0.354741 -0.003655
C -9.150690 -0.528658 -0.003634
C 2.317146 0.249476 0.000641
C 3.502902 -0.564390 0.006358
C 4.742229 0.152953 -0.000517
C 3.869705 -1.953019 0.017616
C 3.699377 2.161315 -0.016606
H -3.982556 -1.081928 -0.887393
H -3.983699 -1.078982 0.889862
H -2.742534 1.131700 0.886346
H -2.740729 1.127762 -0.890387
H -5.317583 1.072928 -0.891241
H -5.319010 1.075313 0.885298
H -1.404961 -1.021867 -0.887911
H -1.406442 -1.016838 0.897029
H -6.564917 -1.133899 0.887162
H -6.563791 -1.135868 -0.889484
H -0.163256 1.199147 -0.887300
H -0.166208 1.206308 0.884081
H -7.896240 1.021123 0.883169
H -7.895001 1.019312 -0.891855
H 0.955143 -1.298367 0.014775
H -10.071687 0.083153 -0.004625
H -9.177506 -1.182439 -0.896263
H -9.178470 -1.180983 0.890034
H 3.244947 -2.845215 0.025452
H 6.742000 -0.664791 0.005068
H 3.741272 3.254847 -0.025441


