%chk=000294848.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294848

0 1
O 2.846497 1.586403 0.089799
O -6.857548 2.068559 0.054591
O -4.911426 3.000572 -0.001063
O 6.719337 2.180258 0.717409
O 4.714688 2.986083 0.561288
O -5.735762 -3.959052 -0.504588
O -7.453206 -2.652415 -0.322188
O 5.978096 -3.771750 -0.858979
O 7.614851 -2.441285 -0.363650
N -2.744722 1.582469 -0.119396
N -5.646060 2.010243 -0.019648
N -6.254435 -2.860349 -0.391322
N 5.524480 2.082665 0.500367
N 6.437381 -2.685772 -0.549488
C -3.597325 0.511028 -0.199642
C -1.305926 1.489009 -0.084705
C -5.020573 0.699452 -0.141544
C 1.439705 1.443630 0.004538
C -0.660685 0.743986 0.919624
C -0.572731 2.218875 -1.039873
C -3.099999 -0.825791 -0.356256
C 3.644134 0.496897 -0.080136
C 0.733225 0.716491 0.967093
C 0.820925 2.197297 -0.998537
C -5.880748 -0.416372 -0.203113
C -5.358770 -1.697024 -0.332999
C 5.027072 0.744373 0.128054
C -3.952646 -1.898471 -0.419847
C 3.189287 -0.786341 -0.450380
C 5.943175 -0.306814 -0.026270
C 5.479064 -1.574877 -0.386809
C 4.102537 -1.815639 -0.603874
H -3.140708 2.553128 -0.079825
H -1.244027 0.205194 1.670383
H -1.086823 2.800923 -1.809054
H -2.024769 -0.985612 -0.448507
H 1.258023 0.165191 1.748761
H 1.422599 2.763911 -1.713427
H -6.975410 -0.262711 -0.147323
H -3.575483 -2.924004 -0.540924
H 2.127767 -0.963614 -0.628231
H 7.022135 -0.125807 0.138255
H 3.775803 -2.824838 -0.894666


%chk=000294848-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294848

0 1
O 2.894209 1.657611 -0.012647
O -6.870567 2.213188 0.056348
O -4.794646 3.032412 -0.386344
O 6.483673 1.865984 1.876657
O 5.091749 3.113578 0.563255
O -6.115485 -4.006827 0.028836
O -7.815043 -2.480805 0.134534
O 6.228855 -3.678780 -1.152154
O 7.818036 -2.401396 -0.121160
N -2.745667 1.425419 -0.373069
N -5.617225 2.030904 -0.160030
N -6.566092 -2.793923 0.036971
N 5.578627 1.992709 0.962696
N 6.627432 -2.592313 -0.578550
C -3.657614 0.396001 -0.271541
C -1.326339 1.376674 -0.297790
C -5.078695 0.667010 -0.163742
C 1.483128 1.478995 -0.141915
C -0.626567 0.504787 0.580591
C -0.596080 2.321188 -1.069212
C -3.268682 -0.986229 -0.304106
C 3.771851 0.594407 -0.170505
C 0.778895 0.552712 0.657387
C 0.807984 2.379028 -0.989337
C -6.023996 -0.375109 -0.056889
C -5.581423 -1.701727 -0.072342
C 5.107291 0.742902 0.313842
C -4.202425 -2.015466 -0.212239
C 3.408201 -0.624047 -0.804063
C 6.039042 -0.303527 0.199790
C 5.645817 -1.492476 -0.438085
C 4.339076 -1.661963 -0.949587
H -3.203153 2.353390 -0.491317
H -1.173796 -0.167876 1.246845
H -1.132371 3.006271 -1.734191
H -2.215191 -1.232578 -0.450024
H 1.312910 -0.095948 1.358894
H 1.381786 3.108894 -1.566510
H -7.087633 -0.140435 0.034437
H -3.899699 -3.065004 -0.256954
H 2.393516 -0.741424 -1.193334
H 7.049591 -0.190557 0.601068
H 4.077719 -2.597555 -1.450616


