%chk=000214857.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214857

0 1
O 0.677109 1.584845 0.429837
O 4.174109 -1.460472 -0.809234
O -0.173711 -2.368728 -1.762337
N 0.220443 -0.332380 -0.718520
N 2.002545 -1.881282 -1.260485
C 2.624065 0.283646 -0.127607
C -1.267754 -0.009544 -0.785829
C 1.117435 0.588072 -0.101230
C 3.334818 1.366660 -0.980399
C 3.131956 0.290611 1.335558
C 3.033771 -1.062909 -0.733911
C -1.831292 0.069790 0.647665
C 0.612829 -1.580687 -1.280437
C -1.477889 1.278056 -1.574483
C -3.334532 0.070929 0.630622
C 3.275567 2.746111 -0.391690
C 2.461223 -0.759787 2.173087
C -4.043444 1.262363 0.845103
C -4.036847 -1.122955 0.401388
C 4.304948 3.589100 -0.416974
C 3.050260 -1.899010 2.528156
C -5.441073 1.257125 0.833193
C -5.433679 -1.121459 0.389066
C -6.138884 0.067190 0.605103
H -1.759779 -0.866257 -1.330584
H 2.889528 1.394138 -1.999241
H 4.395825 1.054814 -1.129657
H 2.954255 1.296283 1.780419
H 4.237310 0.162650 1.331876
H -1.435847 0.976963 1.158105
H -1.462091 -0.783747 1.253041
H 2.274058 -2.796841 -1.658894
H -2.551593 1.496160 -1.666267
H -1.067975 1.212601 -2.588089
H -1.017234 2.147028 -1.081534
H 2.309989 3.024231 0.047342
H 1.445336 -0.512363 2.488451
H -3.505956 2.192129 1.022585
H -3.494246 -2.051783 0.232944
H 4.252901 4.591814 -0.015023
H 5.273199 3.356246 -0.836099
H 2.570086 -2.647393 3.144099
H 4.055217 -2.175732 2.234512
H -5.987208 2.183746 1.002680
H -5.974562 -2.049725 0.210894
H -7.226582 0.065252 0.596293


%chk=000214857-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214857

0 1
O 0.739620 1.401603 0.847710
O 4.119989 -1.714150 -0.613126
O -0.294358 -2.251358 -1.875394
N 0.211080 -0.300502 -0.651607
N 1.894263 -1.919568 -1.195971
C 2.637842 0.166302 -0.055142
C -1.245486 0.103263 -0.705854
C 1.134331 0.457952 0.109527
C 3.210266 1.193999 -1.132110
C 3.377505 0.351472 1.308755
C 2.962060 -1.223460 -0.614172
C -1.933534 -0.132671 0.673443
C 0.546113 -1.525993 -1.281553
C -1.416538 1.531842 -1.256333
C -3.450111 -0.044362 0.568023
C 3.157682 2.645832 -0.708752
C 2.844125 -0.547426 2.406500
C -4.160255 1.050717 1.121863
C -4.182917 -1.058533 -0.103954
C 4.236401 3.468306 -0.704257
C 3.519308 -1.596766 2.938886
C -5.567382 1.133610 1.008864
C -5.588035 -0.979605 -0.219387
C -6.286012 0.118665 0.336570
H -1.686310 -0.607367 -1.425891
H 2.640821 1.056344 -2.075208
H 4.255381 0.893562 -1.331538
H 3.265699 1.411061 1.600071
H 4.448164 0.149322 1.130487
H -1.548655 0.602303 1.400119
H -1.642537 -1.141550 1.026129
H 2.104518 -2.830371 -1.617944
H -2.493072 1.727699 -1.399806
H -0.919094 1.636018 -2.237317
H -1.013293 2.288922 -0.565425
H 2.175463 3.038968 -0.413499
H 1.842573 -0.297184 2.787617
H -3.607066 1.839398 1.646565
H -3.648827 -1.917890 -0.529838
H 4.148190 4.523702 -0.423497
H 5.236644 3.112999 -0.982808
H 3.089160 -2.207928 3.740691
H 4.519262 -1.873636 2.583201
H -6.100902 1.985367 1.445882
H -6.138812 -1.773235 -0.736969
H -7.376662 0.179827 0.249944


