%chk=000291385.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291385

0 1
O 1.940975 -3.417967 1.664134
O -0.740267 1.554110 -2.046228
O -0.176256 -3.231107 1.292282
O -1.010683 2.407540 -0.073787
O 5.065506 -0.008948 0.615650
O 4.412661 1.852278 -0.281303
N -2.199902 -0.275231 -0.265206
N -1.161167 -1.106173 0.237321
N 0.977649 -2.796224 1.262432
N -0.530039 1.611338 -0.852784
N 4.212016 0.739672 0.173843
C -4.871603 0.563636 -0.995261
C -4.159482 1.097822 0.252904
C -3.845071 0.105483 -2.037699
C -3.183862 0.058897 0.828212
C -2.871653 -0.927397 -1.447919
C 0.116751 -0.638814 0.210044
C 1.193674 -1.462506 0.714361
C 0.486253 0.661483 -0.302439
C 2.520776 -1.000210 0.695938
C 1.794446 1.096785 -0.311884
C 2.821697 0.261230 0.190710
H -5.546517 -0.270870 -0.726367
H -5.519139 1.352131 -1.425724
H -3.597799 2.025090 -0.000945
H -4.892289 1.383768 1.030310
H -4.349839 -0.327842 -2.921175
H -3.267091 0.981895 -2.408682
H -2.623862 0.500738 1.682892
H -3.730134 -0.829710 1.207103
H -3.402532 -1.865251 -1.182957
H -2.091322 -1.182032 -2.199901
H -1.380019 -2.059648 0.620126
H 3.330975 -1.647236 1.087277
H 2.069247 2.090671 -0.704776


%chk=000291385-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291385

0 1
O 1.995813 -3.514099 1.632764
O -0.734347 2.138291 -1.595830
O -0.253683 -3.177875 1.543733
O -1.084758 2.312263 0.660545
O 5.155106 -0.228389 0.171937
O 4.440416 1.757961 -0.707139
N -2.228780 -0.231802 -0.163561
N -1.205742 -0.997688 0.459810
N 0.980564 -2.779379 1.346189
N -0.566621 1.749923 -0.379832
N 4.227114 0.597132 -0.179518
C -4.872978 0.452593 -1.177916
C -4.310222 1.088750 0.112903
C -3.717581 0.055216 -2.123765
C -3.299529 0.150108 0.803551
C -2.726407 -0.888803 -1.413323
C 0.096629 -0.592427 0.388212
C 1.203070 -1.447027 0.774255
C 0.465638 0.703495 -0.121330
C 2.545080 -1.056908 0.596503
C 1.786439 1.086977 -0.327359
C 2.824818 0.192080 0.031695
H -5.471535 -0.446613 -0.922808
H -5.554397 1.159701 -1.685015
H -3.801220 2.040784 -0.126466
H -5.122752 1.317007 0.827540
H -4.102531 -0.451727 -3.028211
H -3.173696 0.960827 -2.451949
H -2.812738 0.660706 1.651725
H -3.821353 -0.759486 1.188156
H -3.223495 -1.860133 -1.175469
H -1.853083 -1.095787 -2.056243
H -1.379201 -1.933482 0.877128
H 3.352095 -1.734399 0.887631
H 2.035965 2.069611 -0.738039


