%chk=000223570.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223570

0 1
O 1.305637 -0.138211 1.105603
O -3.396236 2.597268 0.774976
O -5.307517 -1.153897 -1.131553
N -0.759324 0.981535 0.925069
N -3.083598 -1.319017 -0.565164
N -4.354201 0.728487 -0.175105
N -0.685879 -1.204871 0.152449
C -2.050816 0.649862 0.444696
C -1.968620 -0.691411 -0.021636
C 0.011064 -0.156799 0.731380
C -3.244931 1.450001 0.399999
C -4.327446 -0.611616 -0.657269
C -0.371325 2.261581 1.517891
C 2.063137 -1.388617 0.818345
C -2.994058 -2.716755 -1.052290
C 3.448362 -1.052138 1.351520
C -5.666128 1.423995 -0.290325
C 4.368001 -0.508777 0.291643
C 5.597064 -1.130351 0.031611
C 3.999532 0.636808 -0.431831
C 6.450521 -0.607161 -0.945156
C 4.854822 1.153180 -1.406697
C 6.082589 0.532929 -1.665021
H 0.464836 2.716178 0.956100
H -1.232662 2.968158 1.496716
H -0.059456 2.130003 2.570242
H 1.565195 -2.208929 1.362058
H 2.022611 -1.565005 -0.270537
H -3.971421 -3.040890 -1.459341
H -2.708580 -3.391530 -0.225846
H -2.230755 -2.795938 -1.846784
H 3.352062 -0.297909 2.170698
H 3.883206 -1.949321 1.839853
H -5.580674 2.454762 0.103327
H -6.439185 0.884756 0.283758
H -5.986290 1.469337 -1.345547
H 5.892685 -2.018907 0.585064
H 3.040929 1.115334 -0.229338
H 7.404991 -1.092080 -1.144781
H 4.565805 2.040765 -1.967660
H 6.748153 0.937391 -2.424818


%chk=000223570-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223570

0 1
O 1.352768 -0.244599 1.090541
O -3.175555 2.743094 0.207626
O -5.337094 -1.279697 -0.986930
N -0.639960 0.968738 0.688607
N -3.079690 -1.417890 -0.357857
N -4.235581 0.702225 -0.388267
N -0.709297 -1.304035 0.340341
C -1.951489 0.650654 0.266057
C -1.948486 -0.738707 0.065255
C 0.042834 -0.231997 0.712423
C -3.101416 1.481438 0.051063
C -4.279361 -0.703096 -0.600868
C -0.105488 2.297773 1.025700
C 2.031277 -1.574394 1.012184
C -3.048373 -2.879173 -0.555528
C 3.495021 -1.353474 1.416809
C -5.502108 1.422455 -0.652725
C 4.291304 -0.528511 0.414337
C 4.967564 -1.158526 -0.661812
C 4.352928 0.884269 0.520682
C 5.684475 -0.396915 -1.612527
C 5.070341 1.649568 -0.426092
C 5.738277 1.011323 -1.497087
H 0.774278 2.521643 0.398959
H -0.899793 3.036629 0.839928
H 0.193066 2.333894 2.087463
H 1.510463 -2.264145 1.701058
H 1.931763 -1.954953 -0.020067
H -4.052029 -3.190664 -0.879295
H -2.778054 -3.383059 0.387659
H -2.301571 -3.142624 -1.323369
H 3.510738 -0.879118 2.415437
H 3.948155 -2.357681 1.527831
H -5.316394 2.489312 -0.460735
H -6.298990 1.043245 0.007918
H -5.815872 1.264509 -1.697449
H 4.939227 -2.252092 -0.753282
H 3.832330 1.382657 1.346812
H 6.204062 -0.899957 -2.435916
H 5.111025 2.740410 -0.328168
H 6.296806 1.603673 -2.230420


