%chk=000245773.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245773

0 1
O -0.213637 -2.376479 1.946599
O -1.115804 0.103746 2.138193
O -3.600993 -0.631412 -2.557846
O 5.042527 2.005280 0.343038
N 4.829029 0.218390 -1.102190
C -0.169711 -2.080774 0.557943
C -1.331894 -1.181011 0.150313
C 1.141889 -1.448839 0.139903
C -2.921799 0.731186 0.739574
C -1.735122 -0.095651 1.109935
C -3.575719 0.550368 -0.495019
C -1.960345 -1.342229 -1.018496
C -3.097425 -0.483877 -1.465523
C 1.859467 -1.997107 -0.932342
C 1.657275 -0.332251 0.813475
C -3.381865 1.701244 1.634837
C -4.679875 1.340148 -0.821962
C 3.581169 -0.313598 -0.651271
C 3.071081 -1.438799 -1.335136
C 2.867883 0.238545 0.427913
C -4.492930 2.490483 1.303528
C -5.138824 2.311135 0.080704
C 5.494003 1.352638 -0.573953
C 6.796370 1.657809 -1.260116
H -0.294533 -3.103239 0.114628
H -1.681172 -2.119834 -1.737133
H 1.474798 -2.870068 -1.460405
H 1.104551 0.100673 1.654010
H -2.867586 1.838395 2.591601
H -5.179724 1.194519 -1.784905
H 3.612629 -1.877096 -2.169335
H 3.258856 1.111385 0.964145
H -0.075437 -1.560603 2.501237
H -4.847814 3.245156 2.006694
H -6.002468 2.924749 -0.179375
H 5.266020 -0.282107 -1.878737
H 7.524378 0.840867 -1.168412
H 7.258921 2.547948 -0.798544
H 6.669633 1.885308 -2.326771


%chk=000245773-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245773

0 1
O -0.212070 -2.552039 1.922897
O -1.197400 0.009727 2.237205
O -3.835530 -0.817445 -2.502964
O 5.196166 2.084754 0.421332
N 4.878783 0.291243 -1.063654
C -0.169291 -2.107122 0.526247
C -1.382542 -1.236223 0.174129
C 1.151554 -1.431167 0.131866
C -2.958301 0.713347 0.747050
C -1.806477 -0.154638 1.123409
C -3.654410 0.506062 -0.479161
C -2.083432 -1.428011 -0.990231
C -3.235583 -0.594139 -1.401523
C 1.902527 -1.953501 -0.950368
C 1.669194 -0.307421 0.826193
C -3.363979 1.753543 1.619207
C -4.747052 1.336721 -0.818739
C 3.635019 -0.246771 -0.628873
C 3.126602 -1.373191 -1.330388
C 2.894802 0.284561 0.462452
C -4.452598 2.580832 1.273014
C -5.145018 2.372356 0.053784
C 5.591110 1.383932 -0.554288
C 6.901763 1.657426 -1.294082
H -0.253887 -3.042623 -0.053971
H -1.805865 -2.223387 -1.693080
H 1.534538 -2.831262 -1.495524
H 1.113990 0.113971 1.670723
H -2.815479 1.893115 2.555922
H -5.266069 1.152797 -1.764869
H 3.693735 -1.799940 -2.168143
H 3.288759 1.146334 1.003333
H -0.300222 -1.735304 2.489251
H -4.763674 3.385274 1.947577
H -5.990593 3.016011 -0.210834
H 5.307835 -0.190634 -1.857837
H 7.585225 0.789756 -1.237316
H 7.392079 2.523598 -0.827509
H 6.721591 1.884455 -2.361440


