%chk=000187769.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187769

0 1
N -2.650446 0.788175 -0.357739
N 0.586679 -1.312898 -0.181195
C -1.890791 -0.518725 -0.392402
C -2.450227 -1.355923 0.798116
C -0.400051 -0.306365 -0.231734
C -3.220378 0.964729 1.018186
C -3.440786 -0.458296 1.556859
C -1.895706 1.975913 -0.841772
C 0.218430 0.936217 -0.111795
C -0.532185 2.214213 -0.156655
C -2.183617 -1.179241 -1.748870
C 1.630165 0.721022 0.035205
C 1.840130 -0.702836 -0.008772
C 0.364370 -2.757932 -0.287765
C 2.739488 1.572637 0.198850
C 3.130014 -1.264040 0.111533
C 3.999887 1.014833 0.314236
C 4.190909 -0.392546 0.271088
H -1.636096 -1.681514 1.467867
H -2.946834 -2.271862 0.440614
H -4.173522 1.521560 0.916892
H -2.562155 1.545861 1.695075
H -4.479718 -0.785993 1.374361
H -3.280232 -0.506398 2.645811
H -2.544461 2.869524 -0.731395
H -1.738034 1.828973 -1.934896
H -0.670811 2.608508 0.870730
H 0.038502 2.989240 -0.704678
H -3.265574 -1.237358 -1.924792
H -1.759514 -0.591895 -2.572578
H -1.764394 -2.190464 -1.805735
H 0.273846 -3.220219 0.711673
H -0.563687 -2.968939 -0.858305
H 1.202203 -3.244040 -0.818520
H 2.590521 2.648937 0.232454
H 3.274332 -2.337748 0.081441
H 4.870969 1.652982 0.441381
H 5.203273 -0.781590 0.367926


%chk=000187769-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187769

0 1
N -2.617930 0.790896 -0.274021
N 0.596934 -1.309478 -0.124341
C -1.893453 -0.530217 -0.390397
C -2.504732 -1.378112 0.795953
C -0.392611 -0.297882 -0.215278
C -3.124155 0.932621 1.111204
C -3.620911 -0.492736 1.414734
C -1.929562 1.964844 -0.851850
C 0.223483 0.955894 -0.125880
C -0.542751 2.252340 -0.204590
C -2.215451 -1.149252 -1.778023
C 1.644788 0.733011 0.031400
C 1.849578 -0.692993 0.020991
C 0.422104 -2.760677 -0.202056
C 2.767597 1.589044 0.174927
C 3.132873 -1.269621 0.143823
C 4.050845 1.019056 0.301358
C 4.231730 -0.395177 0.285659
H -1.726327 -1.582462 1.552698
H -2.896703 -2.347003 0.438064
H -3.928270 1.690418 1.145527
H -2.336947 1.229334 1.847737
H -4.584230 -0.664157 0.902954
H -3.757652 -0.679774 2.494021
H -2.599261 2.839349 -0.750611
H -1.787479 1.783774 -1.934466
H -0.675598 2.700827 0.802209
H 0.003985 3.002085 -0.810377
H -3.302129 -1.327996 -1.853814
H -1.922124 -0.456811 -2.587042
H -1.683483 -2.103795 -1.943887
H 0.997678 -3.254749 0.602070
H -0.636444 -3.025474 -0.073315
H 0.769156 -3.160776 -1.174779
H 2.640413 2.677776 0.188638
H 3.283323 -2.354746 0.125799
H 4.926523 1.668643 0.412475
H 5.241691 -0.809523 0.383189


