%chk=000211987.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211987

0 1
O -0.128762 -3.029901 -0.923406
O 1.853096 -1.187345 0.115200
N -2.196537 -0.162068 0.051746
C -2.624760 -0.210543 1.497592
C -2.976580 0.745417 -0.860045
C -4.060428 0.350753 1.695725
C -3.356208 2.030244 -0.079660
C -4.250403 1.762465 1.134821
C -1.821359 -1.452170 -0.582913
C -2.618698 -1.635677 2.095057
C -1.596388 0.641428 2.274148
C -2.043427 1.157814 -2.024777
C -4.238918 0.076957 -1.448547
C -0.377059 -1.822387 -0.176208
C 0.639553 -0.742343 -0.566603
C 2.992315 -0.427906 -0.016112
C 3.090617 0.754365 -0.754949
C 4.090194 -0.968991 0.685853
C 4.329815 1.418523 -0.794507
C 5.302913 -0.291448 0.629439
C 5.431469 0.895893 -0.104386
C 4.454500 2.684094 -1.580221
H -4.313404 0.339714 2.771250
H -4.780817 -0.337221 1.207516
H -3.850467 2.742832 -0.763808
H -2.422426 2.527457 0.254715
H -5.313603 1.907631 0.863087
H -4.035340 2.513257 1.919605
H -2.496097 -2.298541 -0.327934
H -1.860861 -1.373209 -1.694593
H -2.930643 -1.618936 3.144535
H -3.293800 -2.313416 1.563410
H -1.614187 -2.082053 2.074426
H -1.843400 0.696382 3.336909
H -0.587365 0.224895 2.180581
H -1.552790 1.664848 1.884758
H -2.536552 1.871569 -2.690359
H -1.125712 1.622383 -1.649276
H -1.745044 0.295656 -2.631949
H -3.992524 -0.747994 -2.122533
H -4.881868 -0.327119 -0.657493
H -4.835979 0.794268 -2.018903
H -0.294056 -2.064041 0.911589
H 0.348783 0.252739 -0.181624
H 0.828544 -0.710473 -1.651077
H 0.808228 -3.300553 -0.812674
H 2.241866 1.163428 -1.288987
H 3.969365 -1.888494 1.249474
H 6.166956 -0.688603 1.163310
H 6.388662 1.407264 -0.134357
H 3.757899 3.451013 -1.212295
H 5.462625 3.115974 -1.534649
H 4.222861 2.516869 -2.642000


%chk=000211987-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211987

0 1
O 0.039360 -3.076241 -0.560877
O 2.015172 -1.219440 0.173255
N -2.334006 -0.249794 0.157483
C -2.890729 -0.296174 1.566339
C -2.883345 0.748519 -0.827261
C -4.296220 0.377303 1.627203
C -3.290408 2.035362 -0.056027
C -4.346211 1.815700 1.055868
C -1.743827 -1.476885 -0.406238
C -3.091761 -1.750740 2.078927
C -1.916213 0.429579 2.545753
C -1.777981 1.180041 -1.836684
C -4.091871 0.191090 -1.649943
C -0.300573 -1.786821 0.063547
C 0.719837 -0.722725 -0.338203
C 3.169758 -0.456759 -0.081479
C 3.170925 0.763111 -0.796864
C 4.375994 -0.990560 0.436540
C 4.386950 1.467877 -1.005057
C 5.578634 -0.290416 0.229362
C 5.589791 0.932219 -0.486855
C 4.379675 2.777837 -1.776430
H -4.634501 0.378872 2.681527
H -5.003370 -0.271435 1.076106
H -3.659872 2.777510 -0.789159
H -2.366044 2.458662 0.381557
H -5.362696 2.012400 0.665676
H -4.177505 2.555072 1.861394
H -2.334334 -2.389943 -0.191858
H -1.712714 -1.401839 -1.506675
H -3.504302 -1.707150 3.103214
H -3.809628 -2.309372 1.451395
H -2.150484 -2.324286 2.128272
H -2.292110 0.386174 3.586860
H -0.919706 -0.047071 2.519457
H -1.787620 1.489824 2.268945
H -2.162618 1.990157 -2.483711
H -0.893230 1.560504 -1.295600
H -1.457462 0.357511 -2.500488
H -3.813102 -0.749988 -2.159602
H -4.963980 -0.018467 -1.008339
H -4.404901 0.913601 -2.427719
H -0.266202 -1.891310 1.168792
H 0.470156 0.252205 0.120639
H 0.769903 -0.624599 -1.441398
H 1.001092 -3.242557 -0.379749
H 2.240325 1.179430 -1.197176
H 4.345840 -1.934212 0.989777
H 6.514559 -0.697488 0.628253
H 6.532958 1.468257 -0.641613
H 3.730514 3.529085 -1.288202
H 5.393765 3.206266 -1.849620
H 3.998116 2.636803 -2.805418


