%chk=000279658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279658

0 1
O -0.334153 1.964465 -0.788014
O 2.485530 1.071972 0.981084
O -3.460391 0.698057 -0.785174
O 3.141309 1.301866 -1.173219
O -2.900417 0.852404 1.400723
N 0.039079 -2.171115 -0.228837
C 1.119595 0.019804 -0.639007
C -1.367212 -0.178506 -0.244026
C 1.315315 -1.399056 -0.022609
C -1.129961 -1.539059 0.470782
C -0.135970 0.737483 -0.092128
C 2.487417 -2.098695 -0.718419
C -0.974935 -1.398739 1.986769
C 0.171849 -3.606770 0.157288
C 2.347734 0.867405 -0.375527
C -2.606394 0.510870 0.281263
C 3.581271 1.926462 1.406540
C -4.707108 1.393494 -0.515315
H 1.019846 -0.093351 -1.751836
H -1.521582 -0.401121 -1.338345
H 1.554265 -1.275409 1.069317
H -2.022953 -2.189143 0.259308
H 0.005579 1.082802 0.962835
H 2.234709 -2.383385 -1.749128
H 2.790958 -3.009165 -0.190070
H 3.374361 -1.454648 -0.772042
H -1.792295 -0.802103 2.424400
H -0.043694 -0.896397 2.274644
H -0.989043 -2.374106 2.483224
H 0.594921 -3.775292 1.158634
H 0.809579 -4.114714 -0.585778
H -0.813771 -4.097749 0.111488
H -0.512353 1.827074 -1.741665
H 4.505599 1.647290 0.890072
H 3.635078 1.733420 2.482631
H 3.314060 2.966091 1.190806
H -5.210089 0.946217 0.348154
H -5.271208 1.246547 -1.441865
H -4.488224 2.450298 -0.332057


%chk=000279658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279658

0 1
O -0.364638 2.011733 -0.668225
O 2.565788 1.122169 0.960229
O -3.476735 0.745270 -0.858076
O 3.029090 1.384196 -1.307458
O -2.945272 0.839274 1.404948
N 0.066732 -2.207482 -0.162370
C 1.103639 0.002346 -0.588154
C -1.383491 -0.224321 -0.215032
C 1.318465 -1.419572 0.031114
C -1.137830 -1.599546 0.487714
C -0.159406 0.703400 -0.026681
C 2.527573 -2.102553 -0.639869
C -1.074755 -1.535778 2.038859
C 0.191528 -3.653305 0.121920
C 2.319589 0.898996 -0.398659
C -2.645969 0.490585 0.240276
C 3.693534 2.034661 1.267131
C -4.716099 1.503501 -0.555938
H 0.975227 -0.131133 -1.680691
H -1.493289 -0.440612 -1.294261
H 1.555785 -1.284562 1.113946
H -1.989707 -2.253027 0.212301
H -0.022075 0.958993 1.035432
H 2.311901 -2.316275 -1.702716
H 2.797536 -3.045859 -0.135936
H 3.411840 -1.443096 -0.595913
H -1.996212 -1.091026 2.447165
H -0.228928 -0.927508 2.403499
H -0.964292 -2.554970 2.451456
H 0.549825 -3.887859 1.153312
H 0.881828 -4.128289 -0.594032
H -0.798135 -4.126486 -0.008739
H -0.494278 1.876726 -1.642933
H 4.635536 1.630402 0.859541
H 3.723669 2.086210 2.364412
H 3.504163 3.027595 0.826620
H -5.348654 0.937384 0.148382
H -5.214787 1.625688 -1.527558
H -4.462395 2.479626 -0.110118


