%chk=000115029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000115029

0 1
P 5.389191 -0.077755 1.341604
O 2.446619 -0.391987 -1.658943
O 4.301717 1.168114 1.009734
O 4.460450 -1.449110 1.197332
O 3.268615 2.709147 -1.053996
O 5.473634 -0.051610 2.966714
O 6.627837 0.039647 0.586787
O -4.945859 -1.163253 1.774204
N 0.376474 0.668594 -1.542526
N -1.757391 0.158275 -2.252476
N 0.034504 0.260622 0.919396
N -2.262888 -0.408615 1.441418
N -3.957303 -0.656426 -0.267060
C 3.138596 0.663171 0.350673
C 3.566526 -0.349464 -0.748714
C 2.404500 1.750355 -0.459062
C 1.812167 0.928729 -1.656547
C 3.857049 -1.701002 -0.099414
C -0.351603 0.308560 -0.394696
C -0.540748 0.526368 -2.648645
C -1.683638 0.011769 -0.853480
C -2.651688 -0.358957 0.130326
C -0.968100 -0.102160 1.768070
C -5.060489 -1.048212 0.585243
C -6.320033 -1.279147 -0.223236
C -7.480522 -1.691576 0.695628
C -8.761043 -1.930660 -0.094952
H 2.445534 0.224937 1.116808
H 4.431438 0.019917 -1.359004
H 1.639742 2.307401 0.125224
H 2.051710 1.393418 -2.645111
H 2.938898 -2.274170 0.144699
H 4.547807 -2.338021 -0.683357
H 4.125896 2.758315 -0.549857
H -0.226028 0.724398 -3.666093
H 4.665481 -0.347902 3.473070
H -0.720161 -0.158928 2.843375
H -4.120821 -0.580487 -1.283201
H -6.596430 -0.361989 -0.784877
H -6.152798 -2.065401 -0.989278
H -7.201317 -2.604271 1.262342
H -7.643284 -0.908439 1.465277
H -9.086696 -1.031502 -0.630737
H -9.582306 -2.224360 0.571490
H -8.643738 -2.731531 -0.834155


%chk=000115029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115029

0 1
P 5.646168 0.247097 1.309938
O 2.429611 -0.570074 -1.575890
O 4.310917 1.351734 0.941799
O 4.836319 -1.299477 1.185682
O 3.228644 2.572326 -1.265935
O 5.841492 0.302292 2.998002
O 6.969952 0.547366 0.512485
O -5.102267 -1.387550 1.872127
N 0.281571 0.480413 -1.471764
N -1.901959 0.127996 -2.100910
N 0.075856 -0.098863 0.953260
N -2.230363 -0.734081 1.550037
N -3.994551 -0.749423 -0.116814
C 3.155144 0.670427 0.313956
C 3.619723 -0.364629 -0.734988
C 2.346135 1.662576 -0.543787
C 1.704390 0.740147 -1.626811
C 4.089695 -1.661519 -0.066359
C -0.398491 0.069617 -0.313080
C -0.674206 0.482454 -2.507845
C -1.741955 -0.134126 -0.726177
C -2.670826 -0.550446 0.270704
C -0.908203 -0.502294 1.817018
C -5.132255 -1.142431 0.645208
C -6.397991 -1.229521 -0.222580
C -7.657351 -1.581496 0.592750
C -8.915230 -1.670543 -0.295804
H 2.502339 0.206814 1.072767
H 4.438838 0.083424 -1.338169
H 1.589027 2.211227 0.043314
H 1.866544 1.203308 -2.616105
H 3.236226 -2.263821 0.283382
H 4.753851 -2.263861 -0.706297
H 3.954312 2.848716 -0.643847
H -0.406956 0.753843 -3.527346
H 5.099444 -0.094423 3.523679
H -0.603793 -0.660281 2.855610
H -4.153977 -0.572073 -1.115821
H -6.543637 -0.262364 -0.748118
H -6.235787 -1.990153 -1.015225
H -7.489756 -2.538789 1.119299
H -7.799281 -0.822228 1.383847
H -9.118393 -0.709329 -0.805258
H -9.805986 -1.925564 0.305888
H -8.803482 -2.447615 -1.075826


