%chk=000272951.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272951

0 1
O -2.177888 2.172742 0.115739
O 2.544894 1.976281 0.450674
O 0.727329 -0.535175 -0.913524
O -2.798534 0.574824 1.593003
O 3.351387 0.686940 2.127419
N 0.013382 0.347774 1.065975
C 0.171023 1.746564 0.620214
C -1.081549 2.568475 0.982446
C 1.418910 2.388247 1.266177
C 0.268191 -0.723210 0.204154
C -0.034107 -2.074181 0.771400
C -2.974289 1.118409 0.522398
C 3.396026 1.008859 0.963959
C 0.924676 -3.086440 0.624577
C -1.255055 -2.339439 1.406204
C -4.001403 0.826113 -0.500528
C 4.291266 0.536591 -0.117984
C 0.664057 -4.364232 1.126830
C -1.510686 -3.620994 1.901154
C -0.552002 -4.630990 1.764680
C -5.087893 0.012055 -0.137600
C 5.666320 0.412509 0.132805
C -3.897051 1.331142 -1.805424
C 3.754406 0.191179 -1.365967
C -6.069644 -0.289441 -1.082600
C 6.507636 -0.051285 -0.879989
C -4.883331 1.022599 -2.745595
C 4.605305 -0.277358 -2.371520
C -5.967012 0.214929 -2.384739
C 5.977330 -0.394651 -2.130243
H 0.314817 1.746338 -0.504343
H -0.969787 3.638245 0.723087
H -1.384537 2.458020 2.039906
H 1.572789 2.087302 2.320192
H 1.430619 3.488119 1.175238
H -0.393058 0.198620 1.990311
H 1.866482 -2.872310 0.115408
H -2.009011 -1.552537 1.512322
H 1.408446 -5.151568 1.018995
H -2.458005 -3.831621 2.394816
H -5.154241 -0.379746 0.880427
H 6.068517 0.672936 1.112717
H -3.044428 1.959482 -2.077216
H 2.672031 0.277037 -1.539760
H -0.753542 -5.627880 2.155001
H -6.914414 -0.919613 -0.807059
H 7.576254 -0.148561 -0.696557
H -4.805165 1.409994 -3.760913
H 4.193460 -0.551124 -3.342177
H -6.734788 -0.024800 -3.121240
H 6.638366 -0.757170 -2.917149


%chk=000272951-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272951

0 1
O -2.365888 2.260978 -0.233174
O 2.579952 2.054799 -0.010715
O 0.864884 -0.177698 -1.723862
O -2.605726 0.890698 1.644088
O 3.033633 1.405279 2.192162
N 0.072719 0.650877 0.304706
C 0.125031 2.052041 -0.115899
C -1.126312 2.825771 0.349640
C 1.380806 2.783319 0.431612
C 0.405212 -0.389930 -0.555727
C 0.199427 -1.784749 -0.021215
C -3.030634 1.287886 0.525881
C 3.274061 1.311663 0.963326
C 0.912996 -2.834166 -0.654502
C -0.683491 -2.089094 1.049212
C -4.273350 0.811101 -0.136979
C 4.315708 0.449796 0.341684
C 0.766183 -4.165195 -0.213999
C -0.832411 -3.424227 1.485002
C -0.105168 -4.463899 0.860460
C -5.065201 -0.148045 0.548027
C 5.314282 -0.107408 1.182730
C -4.674434 1.280847 -1.415449
C 4.304542 0.155638 -1.047315
C -6.250889 -0.631654 -0.039772
C 6.310682 -0.939456 0.633772
C -5.861708 0.792420 -1.999095
C 5.301537 -0.683671 -1.588014
C -6.651199 -0.162059 -1.314004
C 6.307127 -1.226491 -0.753007
H 0.180557 2.041392 -1.219603
H -1.095376 3.862961 -0.022182
H -1.212092 2.820798 1.452657
H 1.372281 2.839974 1.536555
H 1.458942 3.795370 -0.001886
H -0.263693 0.446011 1.248138
H 1.571814 -2.578466 -1.490744
H -1.287093 -1.307458 1.526972
H 1.327380 -4.968095 -0.704548
H -1.520139 -3.653089 2.306541
H -4.735180 -0.496450 1.532189
H 5.289900 0.120243 2.253608
H -4.053684 2.015163 -1.935688
H 3.505695 0.561894 -1.674346
H -0.221466 -5.498059 1.203802
H -6.861263 -1.371367 0.488911
H 7.085547 -1.365262 1.280404
H -6.171175 1.151411 -2.986377
H 5.290747 -0.919319 -2.657596
H -7.572518 -0.539368 -1.771680
H 7.080942 -1.875655 -1.178603


