%chk=000212152.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212152

0 1
I -2.356333 -1.252602 3.354737
I -2.491562 -0.135698 -2.710500
O -3.480517 -0.965793 0.684837
O 2.434551 1.276465 -0.313418
N 4.254679 -0.469736 0.975351
N 2.853288 -0.631020 0.871470
C 5.002363 -0.980880 -0.239053
C 6.398524 -1.363724 0.266507
C 5.082647 0.047252 -1.369793
C 0.547416 -0.062519 0.326247
C 1.997671 0.282859 0.245528
C -0.221015 0.024693 -0.838668
C -0.057979 -0.418684 1.546323
C -2.200345 -0.631626 0.385888
C -1.409056 -0.701815 1.567208
C -1.589579 -0.273161 -0.823632
C -4.586522 -0.901235 -0.263749
C -4.981417 0.515354 -0.533023
C -6.034431 0.840592 -1.278006
H 4.483526 -1.901205 -0.613595
H 4.471251 0.537585 1.114300
H 6.991252 -1.817056 -0.534934
H 6.955576 -0.496269 0.638765
H 6.337774 -2.084185 1.092471
H 4.092643 0.463413 -1.614212
H 5.490494 -0.394154 -2.284235
H 5.718466 0.901653 -1.111239
H 2.527964 -1.500204 1.296236
H 0.267944 0.335680 -1.772904
H 0.535838 -0.456910 2.465651
H -4.343638 -1.487449 -1.168713
H -5.351811 -1.442792 0.336918
H -4.347491 1.265940 -0.052573
H -6.326813 1.864883 -1.465667
H -6.680957 0.123643 -1.762424


%chk=000212152-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212152

0 1
I -2.239847 -2.810761 1.849611
I -2.924220 0.030523 -3.618946
O -3.680724 -1.593078 -0.774824
O 2.414279 0.385340 -1.889933
N 3.860659 0.562982 0.489549
N 2.526493 0.056728 0.404861
C 4.902782 -0.508852 0.685533
C 6.258138 0.212165 0.814368
C 4.912978 -1.582340 -0.427814
C 0.404625 -0.399548 -0.750811
C 1.845469 0.029175 -0.806054
C -0.424880 -0.038157 -1.839255
C -0.128360 -1.189573 0.298010
C -2.357972 -1.152846 -0.776498
C -1.488070 -1.552864 0.279373
C -1.778141 -0.419328 -1.853002
C -4.770112 -0.569611 -0.543906
C -4.658273 0.095990 0.802993
C -4.493972 1.434223 0.956253
H 4.665403 -0.994340 1.652699
H 4.034214 1.076764 -0.394614
H 7.059577 -0.513115 1.039320
H 6.523963 0.723326 -0.131078
H 6.224386 0.966314 1.619244
H 3.919186 -2.052123 -0.535152
H 5.644094 -2.377598 -0.191812
H 5.184604 -1.134489 -1.401174
H 2.020115 0.043948 1.291650
H 0.024802 0.517416 -2.666871
H 0.512009 -1.555947 1.105732
H -4.757694 0.173123 -1.361766
H -5.675792 -1.192941 -0.627210
H -4.721546 -0.561945 1.679422
H -4.437494 1.896216 1.948070
H -4.416278 2.106519 0.092132


