%chk=000200929.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200929

0 1
P -2.898758 -0.069937 -0.055463
O -4.267136 -0.355898 -0.558790
N -2.226880 1.471756 -0.576023
N -2.761283 -0.023570 1.683031
N -1.892672 -1.398165 -0.688764
N 0.186855 -0.413184 -0.126081
N 0.071278 -2.592839 -1.257229
N 2.265361 0.600330 0.346776
C -2.872878 2.166890 -1.733386
C -1.479390 1.593738 -1.863094
C -1.831014 -0.877945 2.478021
C -1.615746 0.618834 2.390503
C -0.506002 -1.464321 -0.685740
C 1.572345 -0.478310 -0.166832
C 1.428301 -2.634968 -1.252372
C 2.222753 -1.617886 -0.726446
C 1.571354 1.798156 0.895145
C 3.752357 0.613081 0.382003
C 1.423436 2.892611 -0.158443
C 4.288529 -0.094180 1.625038
H -3.719353 1.725221 -2.274073
H -3.021136 3.243879 -1.593037
H -0.589685 2.244322 -1.798917
H -1.280827 0.736116 -2.511866
H -2.285149 -1.319804 3.374003
H -1.124204 -1.571188 2.013394
H -0.749781 1.026864 1.836644
H -1.902967 1.272479 3.221377
H -2.382842 -2.207270 -1.130156
H 3.301064 -1.696526 -0.747505
H 1.875794 -3.533587 -1.697942
H 2.144476 2.168589 1.773140
H 0.551619 1.501981 1.273184
H 4.099366 1.671324 0.357931
H 4.153893 0.132886 -0.541074
H 2.373680 3.148920 -0.636796
H 0.723113 2.578551 -0.954856
H 1.011448 3.807035 0.284842
H 3.943921 0.384655 2.549529
H 3.960660 -1.141687 1.669479
H 5.384500 -0.090853 1.639447


%chk=000200929-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200929

0 1
P -2.459948 -0.156864 -0.303317
O -3.989905 -0.624683 -0.476522
N -1.939187 1.215340 -1.323009
N -2.023370 0.429201 1.339031
N -1.411360 -1.487725 -0.752577
N 0.611908 -0.475122 -0.140746
N 0.561243 -2.650220 -1.258603
N 2.595320 0.625256 0.429899
C -2.782813 2.474914 -1.252743
C -2.866133 1.576909 -2.473100
C -3.045525 0.126127 2.431433
C -1.716008 -0.600657 2.408184
C -0.014266 -1.530436 -0.711560
C 1.985999 -0.484728 -0.115815
C 1.931239 -2.655169 -1.193271
C 2.699651 -1.616013 -0.644140
C 1.765616 1.741488 0.956534
C 4.063846 0.770396 0.454800
C 1.321182 2.728295 -0.144412
C 4.723277 0.115050 1.690313
H -3.649629 2.487609 -0.580394
H -2.194747 3.397006 -1.281248
H -2.342380 1.849720 -3.393600
H -3.779906 0.980353 -2.588973
H -3.201073 0.957186 3.126156
H -3.944479 -0.429549 2.137390
H -1.714772 -1.660181 2.123501
H -0.911668 -0.302052 3.087236
H -1.867014 -2.304256 -1.169522
H 3.787670 -1.692090 -0.619823
H 2.419569 -3.543771 -1.608907
H 2.363365 2.256981 1.732414
H 0.864997 1.314833 1.428449
H 4.291238 1.852035 0.441987
H 4.493096 0.351960 -0.474768
H 2.185902 3.125127 -0.708754
H 0.629857 2.218978 -0.837358
H 0.785555 3.582189 0.311613
H 4.327262 0.553795 2.623655
H 4.526793 -0.971204 1.715679
H 5.817997 0.270071 1.673492


