%chk=000095561.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000095561

0 1
O 3.829482 -0.061549 0.761003
C -0.374882 0.750906 0.456888
C -1.298184 -0.429152 0.085799
C 1.047389 0.257063 0.790799
C -0.369522 1.816437 -0.659550
C -2.783273 -0.058157 0.192634
C 1.747672 -0.460225 -0.367522
C -3.687699 -1.231414 -0.209832
C 0.247300 3.137345 -0.207999
C 3.225547 -0.653225 -0.104753
C -5.166726 -0.866851 -0.101855
C 3.914238 -1.638336 -1.011981
H -0.777538 1.227407 1.387400
H -1.070485 -0.781017 -0.937505
H -1.085305 -1.287300 0.752356
H 1.011793 -0.411553 1.672815
H 1.669849 1.121948 1.110091
H -1.409556 1.993285 -1.001317
H 0.174945 1.431409 -1.544210
H -3.000456 0.820263 -0.446776
H -3.019648 0.259998 1.226299
H 1.258624 -1.431882 -0.571714
H 1.625953 0.133061 -1.301206
H -3.455982 -1.547880 -1.245501
H -3.472238 -2.109425 0.430079
H 0.233439 3.877757 -1.015307
H -0.294067 3.568113 0.641823
H 1.292250 3.010303 0.101962
H -5.804696 -1.709468 -0.390820
H -5.423313 -0.022874 -0.752142
H -5.439317 -0.585292 0.921712
H 5.007923 -1.565258 -0.913218
H 3.666540 -1.484962 -2.067821
H 3.641345 -2.670271 -0.755531


%chk=000095561-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095561

0 1
O 3.859724 -0.230338 0.923270
C -0.391523 0.796836 0.461115
C -1.323782 -0.387107 0.073315
C 1.043767 0.302850 0.798632
C -0.413285 1.920816 -0.613995
C -2.836340 -0.069583 0.132980
C 1.785110 -0.377837 -0.369852
C -3.721757 -1.300135 -0.172269
C 0.396081 3.182028 -0.237840
C 3.247495 -0.717575 -0.064356
C -5.232282 -0.986317 -0.110652
C 3.932038 -1.686580 -1.025099
H -0.795913 1.239023 1.399130
H -1.071624 -0.742071 -0.948625
H -1.120183 -1.238768 0.757174
H 0.985260 -0.412898 1.642516
H 1.663627 1.141616 1.163390
H -1.465427 2.217106 -0.792066
H -0.045858 1.517485 -1.580929
H -3.088448 0.738221 -0.583504
H -3.088118 0.318673 1.142376
H 1.270616 -1.302370 -0.699811
H 1.796717 0.283621 -1.263541
H -3.464774 -1.693095 -1.177479
H -3.480595 -2.108672 0.548031
H 0.268008 3.975817 -0.996889
H 0.061101 3.589241 0.735085
H 1.477612 2.971358 -0.155698
H -5.842729 -1.882873 -0.324912
H -5.505673 -0.207238 -0.847339
H -5.518279 -0.613904 0.891268
H 5.026273 -1.629518 -0.914233
H 3.644499 -1.488122 -2.073656
H 3.610065 -2.720485 -0.790438


