%chk=000214566.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214566

1 1
O 0.793836 -2.130341 0.312166
O 3.322054 -1.579063 0.004297
O 4.029701 0.560904 -0.158180
N -0.725995 -0.420046 0.125881
N 0.002268 1.825417 -0.123688
C -1.810763 -1.500478 0.211705
C -3.115236 -0.898490 0.738088
C -3.522878 0.332243 -0.063313
C -2.444626 1.419258 0.022462
C -1.039169 0.887680 -0.001834
C -1.946532 -2.152602 -1.156102
C 0.696678 -0.954020 0.149517
C 1.678361 0.101679 -0.023285
C 1.340881 1.417318 -0.145303
C -0.293368 3.279042 -0.227839
C 3.130446 -0.239073 -0.066593
H -1.418752 -2.258369 0.954564
H -3.029824 -0.656280 1.818429
H -3.918359 -1.669868 0.691110
H -4.488986 0.736597 0.311512
H -3.715352 0.058884 -1.123023
H -2.589808 2.004417 0.966857
H -2.608388 2.150884 -0.805914
H -2.706767 -2.951744 -1.132888
H -2.246526 -1.459316 -1.950289
H -1.014001 -2.644762 -1.477377
H 2.118578 2.204205 -0.264666
H -0.813999 3.651207 0.676654
H -0.907812 3.504294 -1.122116
H 0.638608 3.873798 -0.325434
H 4.299832 -1.832476 -0.018898


%chk=000214566-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214566

1 1
O 0.774326 -2.212732 0.295469
O 3.467356 -1.561464 0.000558
O 3.999253 0.701115 -0.137046
N -0.753054 -0.418189 0.099374
N -0.002532 1.802712 -0.118166
C -1.837084 -1.488908 0.197912
C -3.136705 -0.884362 0.754087
C -3.558898 0.353778 -0.055165
C -2.457718 1.431481 0.019932
C -1.042937 0.895257 -0.011190
C -1.993823 -2.179362 -1.176435
C 0.648662 -0.986797 0.137627
C 1.676974 0.042008 -0.018272
C 1.317509 1.367782 -0.132884
C -0.272734 3.267596 -0.239689
C 3.158133 -0.224143 -0.054412
H -1.421063 -2.226276 0.906352
H -3.007179 -0.619604 1.821313
H -3.919518 -1.660548 0.711206
H -4.497614 0.776969 0.339017
H -3.753558 0.079459 -1.106649
H -2.561636 2.003816 0.966140
H -2.582090 2.170943 -0.792805
H -2.711115 -3.011522 -1.071848
H -2.374867 -1.491320 -1.950655
H -1.040166 -2.610518 -1.520142
H 2.099649 2.125245 -0.237274
H -0.936685 3.609276 0.568773
H -0.723821 3.500766 -1.218134
H 0.682128 3.804621 -0.153529
H 4.454908 -1.696180 -0.026968


