%chk=000214570.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214570

1 1
O 0.508293 -1.712167 0.271124
O 2.766929 -0.386767 -0.048758
O 2.750266 1.889713 -0.021565
N -1.450019 -0.531635 0.097857
N -1.433412 1.835260 -0.059049
C -2.159244 -1.888444 0.119197
C -3.591101 -1.731270 0.636473
C -4.342515 -0.649403 -0.130726
C -3.643961 0.707303 0.018313
C -2.142689 0.626332 0.007101
C -2.077982 -2.495411 -1.274340
C 0.068904 -0.612008 0.137545
C 0.685300 0.694602 0.016536
C -0.030552 1.848997 -0.067210
C -2.150432 3.136207 -0.117196
C 2.184270 0.819078 -0.013022
C 4.279399 -0.451444 -0.064573
C 4.762933 -0.136223 1.331908
C 4.498632 -1.878693 -0.512507
H -1.566174 -2.524611 0.842481
H -3.594194 -1.516941 1.725868
H -4.122211 -2.706164 0.544070
H -5.389708 -0.570721 0.235129
H -4.429978 -0.925068 -1.203498
H -3.968658 1.182221 0.979347
H -4.011247 1.388684 -0.786958
H -2.561313 -3.486176 -1.296874
H -2.564703 -1.891152 -2.048468
H -1.036626 -2.667120 -1.591577
H 0.475191 2.836913 -0.143416
H -2.766016 3.299109 0.789166
H -2.796217 3.203150 -1.014859
H -1.437653 3.984935 -0.174706
H 4.609048 0.301973 -0.812969
H 4.570189 0.911663 1.605953
H 5.848227 -0.292348 1.422767
H 4.287045 -0.771046 2.091460
H 4.127394 -2.053415 -1.531268
H 5.566456 -2.139791 -0.499414
H 3.980328 -2.597622 0.140259


%chk=000214570-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214570

1 1
O 0.418449 -1.834382 0.371392
O 2.823185 -0.442165 -0.008386
O 2.689239 1.893084 0.051479
N -1.544953 -0.543392 0.104538
N -1.447347 1.798987 -0.091955
C -2.285063 -1.876218 0.171913
C -3.722350 -1.669388 0.678933
C -4.447960 -0.593568 -0.147331
C -3.700486 0.750091 -0.028482
C -2.190851 0.636384 -0.015500
C -2.192753 -2.577158 -1.202860
C -0.039909 -0.693052 0.186993
C 0.661292 0.582500 0.046370
C -0.056412 1.752189 -0.073490
C -2.114092 3.129510 -0.218011
C 2.165544 0.748313 0.041332
C 4.358436 -0.404221 -0.015377
C 4.835154 -0.252122 1.433166
C 4.773557 -1.708937 -0.690514
H -1.702547 -2.468935 0.898398
H -3.711570 -1.388081 1.749695
H -4.249999 -2.635527 0.606826
H -5.482407 -0.457722 0.209200
H -4.515783 -0.900924 -1.205500
H -3.991443 1.254202 0.917409
H -4.003707 1.436627 -0.840308
H -2.648036 -3.579141 -1.119545
H -2.726116 -2.020910 -1.993104
H -1.144434 -2.717199 -1.510866
H 0.486225 2.698711 -0.153325
H -2.870396 3.262743 0.570453
H -2.585679 3.237426 -1.208751
H -1.351010 3.911532 -0.101862
H 4.640156 0.481588 -0.614124
H 4.494399 0.699968 1.873270
H 5.939736 -0.256740 1.452918
H 4.476898 -1.092092 2.052892
H 4.368865 -1.777183 -1.714183
H 5.875390 -1.754312 -0.751706
H 4.420976 -2.579984 -0.112397


