%chk=000277132.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277132

0 1
S 1.527788 -2.226116 -0.000811
N -4.574692 -0.009223 0.000308
C 0.518261 0.225030 0.000018
C 0.126175 -1.161194 -0.000195
C -0.459316 1.203752 -0.000023
C -1.175518 -1.589129 -0.000111
C 1.984995 0.366849 0.000187
C -1.845299 0.798118 0.000164
C -2.197289 -0.577983 0.000130
C 2.656972 -0.882071 -0.000453
C -0.120047 2.657174 -0.001072
C -1.546509 -3.033389 -0.000312
C 2.765096 1.526524 0.001066
C -2.912367 1.753363 0.000329
C -3.599516 -0.911248 0.000213
C 4.037810 -0.999493 -0.000583
C 4.163191 1.425191 0.000960
C 4.796866 0.178942 0.000069
C -4.222014 1.332201 0.000376
H 0.476041 2.925665 0.885265
H 0.460840 2.927221 -0.896990
H -1.006193 3.310678 0.007148
H -0.681020 -3.711812 0.000000
H -2.140540 -3.293795 0.889215
H -2.139863 -3.293694 -0.890322
H 2.307459 2.513298 0.002131
H -2.667899 2.817402 0.000498
H -3.908649 -1.965161 0.000197
H 4.524467 -1.973176 -0.001129
H 4.763594 2.334245 0.001593
H 5.884338 0.120495 -0.000051
H -5.066464 2.029135 0.000485


%chk=000277132-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277132

0 1
S 1.538899 -2.304755 0.001249
N -4.631493 -0.035150 -0.002066
C 0.520014 0.234416 0.000392
C 0.117620 -1.157865 0.000416
C -0.477796 1.240723 0.001227
C -1.206868 -1.596860 0.000264
C 1.992104 0.375940 -0.000221
C -1.862528 0.831564 0.000199
C -2.220606 -0.578127 -0.000348
C 2.669355 -0.885677 0.000541
C -0.103079 2.711600 0.003838
C -1.566792 -3.070991 0.000552
C 2.812198 1.540978 -0.002213
C -2.962425 1.758918 -0.000724
C -3.618736 -0.921856 -0.001350
C 4.070898 -1.008725 0.000217
C 4.217573 1.434195 -0.002630
C 4.850688 0.167260 -0.001218
C -4.280517 1.304985 -0.001835
H 0.499396 2.968653 0.894791
H 0.491821 2.974382 -0.890617
H -0.982474 3.369799 0.009796
H -0.667686 -3.708429 0.001450
H -2.165090 -3.340149 0.890748
H -2.163762 -3.340831 -0.890336
H 2.369900 2.536200 -0.003894
H -2.790660 2.837731 -0.000901
H -3.915646 -1.976453 -0.001651
H 4.547558 -1.994192 0.000930
H 4.824520 2.345803 -0.004176
H 5.943500 0.095639 -0.001470
H -5.119190 2.009071 -0.002660


