%chk=000250339.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250339

0 1
O 2.059846 1.235540 -2.081909
O 5.829037 0.164046 0.613230
N -4.791863 -0.806504 -0.981167
C -3.086561 -0.072207 0.642897
C -2.064653 -0.652170 -0.190379
C -4.439589 -0.176306 0.210225
C 1.743375 -0.128108 -0.207577
C -0.657088 -0.606945 0.229480
C 0.330192 -0.178259 -0.573737
C 2.656380 0.620512 -1.011507
C -2.812372 0.610935 1.867564
C -2.436742 -1.266014 -1.368984
C 2.266114 -0.796676 0.906344
C -5.491254 0.381941 1.009783
C 4.015024 0.702234 -0.713186
C 4.479181 0.010067 0.422273
C -3.834005 1.140797 2.615990
C 3.622740 -0.741716 1.237477
C -3.819144 -1.320376 -1.728521
C -5.188029 1.021912 2.183583
C 2.891162 2.023325 -2.972270
C 6.437579 -0.498746 1.750100
H -0.472825 -0.950422 1.248819
H 0.107232 0.187498 -1.586139
H -1.776152 0.710479 2.191309
H -1.699176 -1.719459 -2.026234
H 1.594212 -1.385904 1.536149
H -6.517201 0.280217 0.652920
H 4.719992 1.269184 -1.310934
H -3.628698 1.662382 3.549158
H 3.987231 -1.275172 2.106585
H -4.117179 -1.809592 -2.664816
H -5.974283 1.451849 2.803355
H 3.646834 1.389191 -3.444858
H 3.339687 2.860239 -2.428892
H 2.155046 2.377532 -3.706045
H 7.489366 -0.201364 1.645020
H 6.325174 -1.583122 1.661388
H 6.012815 -0.117415 2.683106


%chk=000250339-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250339

0 1
O 2.298550 0.713271 -2.504440
O 5.945098 0.086282 0.615892
N -4.902326 -0.142247 -1.080319
C -3.204171 -0.019967 0.755633
C -2.123944 -0.091918 -0.219122
C -4.572883 -0.056722 0.268714
C 1.774095 0.078385 -0.245743
C -0.716629 -0.094056 0.201790
C 0.360895 0.105032 -0.627867
C 2.779333 0.397215 -1.226568
C -2.998113 0.097730 2.169976
C -2.501830 -0.182136 -1.576626
C 2.236753 -0.251364 1.055383
C -5.659618 0.002595 1.200173
C 4.149559 0.389054 -0.904951
C 4.560076 0.060285 0.409671
C -4.076689 0.157000 3.057215
C 3.601260 -0.265471 1.401673
C -3.873054 -0.195882 -1.952126
C -5.420394 0.105047 2.571242
C 3.274058 1.050511 -3.544194
C 6.438954 -0.237243 1.958112
H -0.530168 -0.265323 1.268237
H 0.184213 0.328418 -1.686032
H -1.982024 0.155793 2.572354
H -1.744086 -0.269129 -2.360939
H 1.504095 -0.514294 1.825607
H -6.672113 -0.031985 0.786300
H 4.924189 0.630694 -1.636294
H -3.892640 0.248446 4.133546
H 3.900436 -0.529042 2.419439
H -4.145815 -0.266629 -3.012341
H -6.257194 0.151168 3.276856
H 3.958901 0.203286 -3.740828
H 3.860352 1.947273 -3.266203
H 2.674359 1.260896 -4.441619
H 7.532889 -0.149331 1.889140
H 6.164339 -1.269539 2.248646
H 6.052694 0.477301 2.710214


