%chk=000213320.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213320

0 1
O -6.552101 1.139670 1.138999
O 5.209403 1.597975 -1.140558
O 6.589672 0.589899 0.506498
O -3.720863 -1.911835 -0.710265
N -4.603860 0.183470 -0.715423
C -4.563272 1.579907 -0.215352
C -5.978683 -0.388994 -0.693535
C -5.213705 1.671209 1.177167
C -6.607069 -0.235793 0.700048
C -3.514641 -0.708481 -0.603570
C -2.154190 -0.128608 -0.470353
C 4.495258 0.621714 -0.458504
C 5.325879 0.015446 0.531831
C 2.703050 -0.793485 0.192082
C 3.187895 0.243806 -0.652505
C 4.866207 -0.990633 1.351356
C 3.524822 -1.389550 1.155129
C -1.096175 -0.936728 -0.295371
C 6.552491 1.603169 -0.552205
C 1.314798 -1.259754 0.048559
C 0.272170 -0.439276 -0.160988
H -5.128419 2.214865 -0.938250
H -3.520907 1.964451 -0.194158
H -5.939837 -1.464535 -0.992300
H -6.583757 0.147118 -1.457800
H -4.631346 1.133353 1.944918
H -5.385103 2.715857 1.492830
H -7.693928 -0.432988 0.694923
H -6.110047 -0.873070 1.451938
H -2.062612 0.955312 -0.536646
H 2.560182 0.698617 -1.413602
H 5.493712 -1.456445 2.106067
H 3.127998 -2.184752 1.787149
H -1.237195 -2.027368 -0.248296
H 6.711904 2.584164 -0.085814
H 7.263422 1.301658 -1.332722
H 1.181231 -2.343482 0.135376
H 0.406615 0.643619 -0.233854


%chk=000213320-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213320

0 1
O -6.985399 1.459612 0.514643
O 5.226231 2.052366 -0.339633
O 6.864590 0.356258 0.124085
O -3.645571 -2.076716 0.040273
N -4.652882 -0.014021 -0.335684
C -4.710582 1.452323 -0.497745
C -5.988353 -0.652981 -0.339382
C -5.647274 2.062769 0.571223
C -6.890773 -0.000016 0.722871
C -3.516459 -0.819018 -0.161680
C -2.176273 -0.179553 -0.229323
C 4.593744 0.806920 -0.097579
C 5.562148 -0.188264 0.174916
C 2.818062 -0.811251 0.161955
C 3.230809 0.537306 -0.113456
C 5.196628 -1.509088 0.444695
C 3.809513 -1.801088 0.433701
C -1.046454 -0.930881 -0.006978
C 6.683372 1.802116 -0.188201
C 1.410109 -1.213877 0.178608
C 0.307111 -0.422091 -0.058322
H -5.109255 1.694798 -1.504531
H -3.711427 1.903471 -0.403530
H -5.844001 -1.727754 -0.139341
H -6.447408 -0.526809 -1.340967
H -5.205620 1.915063 1.581152
H -5.800643 3.139461 0.388309
H -7.925468 -0.372159 0.648695
H -6.490986 -0.207908 1.738380
H -2.073524 0.882724 -0.476954
H 2.508474 1.328451 -0.327346
H 5.945050 -2.276930 0.653911
H 3.484565 -2.826526 0.642105
H -1.198950 -1.994963 0.225985
H 7.067209 2.400202 0.656142
H 7.189577 2.027033 -1.142142
H 1.225801 -2.273534 0.410315
H 0.433307 0.644056 -0.296371


