%chk=000278677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278677

0 1
O -4.090966 -2.537501 -0.255172
O -4.163472 2.699447 -0.122320
O -0.540924 0.036512 1.908890
O 4.234479 0.072713 0.645755
O 4.289478 -2.456449 0.047304
O 4.212803 2.587042 -0.135098
N -1.313186 -2.339379 0.280564
N -1.376275 2.149244 -0.173016
C 0.867843 -1.282390 0.495527
C 0.817173 1.222010 0.345249
C 0.121218 -2.432677 0.207446
C 0.061771 2.308155 -0.089657
C -1.913727 -1.578665 -0.865524
C -2.041173 -3.623127 0.517609
C -2.071987 2.437224 1.126922
C -2.013775 2.932112 -1.281869
C 2.277695 -1.274561 0.390543
C 2.231995 1.240232 0.265134
C 0.236151 -0.008289 0.987994
C 3.023097 0.007090 0.488886
C -3.393198 -1.310930 -0.547215
C -3.501988 -3.261758 0.842887
C -3.536261 2.004948 0.977295
C -3.484892 2.488918 -1.374764
C 0.813499 -3.639986 -0.084948
C 0.739689 3.492809 -0.511777
C 2.927954 -2.487429 0.116733
C 2.871912 2.431583 -0.107988
C 2.195202 -3.677657 -0.107566
C 2.113490 3.568626 -0.507245
H -1.821388 -2.129980 -1.825694
H -1.381356 -0.606758 -0.982802
H -1.580098 -4.144080 1.384366
H -2.010685 -4.310292 -0.355181
H -2.010400 3.507602 1.413853
H -1.581907 1.843736 1.937995
H -1.485427 2.705666 -2.231944
H -1.967132 4.031455 -1.123602
H -3.504693 -0.607726 0.309151
H -3.944331 -0.930529 -1.425483
H -4.146817 -4.154481 0.915132
H -3.576304 -2.652829 1.762140
H -3.624141 0.907930 0.812303
H -4.155835 2.313481 1.837158
H -4.065221 3.122111 -2.069242
H -3.574065 1.426140 -1.659394
H 0.250141 -4.550474 -0.295893
H 0.152527 4.359022 -0.824472
H 2.720335 -4.608916 -0.309413
H 2.647176 4.473500 -0.799789
H 4.676154 -3.346993 -0.162935
H 4.710941 1.738447 0.195469


%chk=000278677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278677

0 1
O -4.071940 -3.164468 -0.705497
O -4.135302 3.079281 0.635060
O -1.304041 -0.022165 -0.060183
O 4.202948 0.024822 -0.312793
O 4.284366 -2.302022 0.911697
O 4.230826 2.412749 -0.893862
N -1.272797 -2.763330 -0.088029
N -1.310523 2.758742 0.093314
C 0.758727 -1.279498 0.061041
C 0.720378 1.287285 -0.117716
C 0.076646 -2.548728 0.229308
C 0.043081 2.559136 -0.216962
C -1.832337 -2.370688 -1.404848
C -2.033718 -3.863679 0.542886
C -1.907408 2.273577 1.360556
C -2.067718 3.887084 -0.492715
C 2.197148 -1.227808 0.217158
C 2.148010 1.249336 -0.310085
C -0.014919 -0.002548 -0.046753
C 2.909067 0.011501 -0.134470
C -3.323794 -2.027601 -1.279860
C -3.527332 -3.480182 0.619191
C -3.388683 1.918602 1.161783
C -3.551376 3.487747 -0.646889
C 0.827851 -3.648300 0.750758
C 0.804593 3.699818 -0.655943
C 2.905429 -2.365097 0.702263
C 2.876307 2.422465 -0.702026
C 2.196977 -3.555222 1.003041
C 2.172911 3.641712 -0.901652
H -1.716034 -3.229571 -2.104937
H -1.283850 -1.509162 -1.806368
H -1.663497 -4.033220 1.569216
H -1.932701 -4.811593 -0.034258
H -1.828762 3.087449 2.117021
H -1.358621 1.396305 1.725338
H -1.664486 4.129303 -1.491172
H -2.002198 4.794728 0.149390
H -3.437613 -1.133114 -0.638136
H -3.774675 -1.851329 -2.269841
H -4.124515 -4.327703 0.995426
H -3.646040 -2.606473 1.295769
H -3.465275 1.065653 0.460662
H -3.870142 1.672738 2.122119
H -4.148661 4.349797 -0.988210
H -3.633529 2.658647 -1.382360
H 0.333577 -4.611431 0.903332
H 0.303015 4.668099 -0.741521
H 2.738754 -4.429275 1.387960
H 2.740302 4.526981 -1.202232
H 4.607812 -3.161865 1.286572
H 4.534860 1.416409 -0.689238


