%chk=000246816.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246816

0 1
O -4.750490 -1.862130 -0.160997
N -6.066572 -0.217105 0.698426
C -7.284231 -0.970662 0.275055
C -6.324080 1.236315 0.874074
C -7.896758 -0.380925 -1.006500
C -6.896930 1.867633 -0.407970
C -8.161268 1.123576 -0.860994
C 0.217555 -0.553247 0.087984
C 1.470988 0.308441 0.290914
C -1.062134 0.233868 0.402204
C 2.749348 -0.480362 -0.023733
C -2.308691 -0.633650 0.196690
C -3.593563 0.144879 0.508905
C 4.003900 0.380134 0.178320
C -4.814493 -0.723662 0.277535
C 5.281820 -0.409260 -0.136505
C 6.536769 0.450685 0.065639
C 7.814607 -0.338854 -0.249208
C 9.069429 0.520888 -0.047052
C 10.348405 -0.267839 -0.361841
C 11.600776 0.582983 -0.162129
H -7.009523 -2.041067 0.116922
H -8.012112 -0.936798 1.113516
H -7.053182 1.346144 1.710697
H -5.403847 1.763777 1.195305
H -7.213950 -0.564128 -1.860062
H -8.834679 -0.913532 -1.249284
H -7.123663 2.935032 -0.231853
H -6.138618 1.842274 -1.213917
H -8.978108 1.292866 -0.133123
H -8.517834 1.537917 -1.822769
H 0.271777 -1.454644 0.729112
H 0.182389 -0.928632 -0.953293
H 1.417310 1.208680 -0.351034
H 1.506721 0.681946 1.332413
H -1.026552 0.606285 1.444104
H -1.115584 1.133876 -0.239966
H 2.803302 -1.380977 0.618019
H 2.713636 -0.855167 -1.064912
H -2.350662 -1.017564 -0.843351
H -2.261383 -1.541243 0.832665
H -3.571618 0.500688 1.559317
H -3.650906 1.050325 -0.128197
H 3.950246 1.280379 -0.463692
H 4.039951 0.754233 1.219614
H 5.335455 -1.309839 0.505188
H 5.245930 -0.783630 -1.177764
H 6.572925 0.824776 1.106937
H 6.483406 1.351107 -0.576172
H 7.778496 -0.713058 -1.290491
H 7.867971 -1.239358 0.392558
H 9.017520 1.421720 -0.688147
H 9.107023 0.895551 0.993825
H 10.312989 -0.641544 -1.403887
H 10.402488 -1.168613 0.280390
H 11.686572 0.938409 0.870972
H 11.597206 1.465107 -0.812373
H 12.507822 0.011794 -0.388984


%chk=000246816-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246816

0 1
O -4.774272 -1.995411 -0.058244
N -6.117028 -0.148247 0.376428
C -7.347442 -0.969834 0.295339
C -6.351387 1.282933 0.657972
C -8.321927 -0.399013 -0.759081
C -7.308216 1.904202 -0.390081
C -8.623100 1.093631 -0.482078
C 0.248859 -0.526636 -0.043170
C 1.519029 0.330640 0.154314
C -1.063954 0.246466 0.215472
C 2.826738 -0.444724 -0.122717
C -2.320133 -0.638989 0.062438
C -3.625315 0.146575 0.297374
C 4.102658 0.395093 0.110318
C -4.872383 -0.750085 0.189323
C 5.406945 -0.382928 -0.175316
C 6.686268 0.445447 0.079327
C 7.988421 -0.335497 -0.208688
C 9.269990 0.485989 0.057015
C 10.570784 -0.298507 -0.229781
C 11.847002 0.527614 0.040242
H -7.035789 -1.998557 0.053506
H -7.839139 -0.977720 1.291944
H -6.808498 1.380742 1.667113
H -5.394747 1.825792 0.675411
H -7.869275 -0.509463 -1.763683
H -9.256352 -0.992118 -0.750322
H -7.515920 2.956438 -0.115257
H -6.806189 1.910089 -1.377597
H -9.174499 1.183545 0.477313
H -9.278318 1.510915 -1.269557
H 0.292610 -1.406027 0.632895
H 0.235897 -0.932162 -1.076409
H 1.471649 1.218766 -0.510657
H 1.538612 0.721777 1.193461
H -1.036203 0.679067 1.238447
H -1.123858 1.107143 -0.484505
H 2.860012 -1.346455 0.524352
H 2.817428 -0.815313 -1.169292
H -2.345269 -1.091915 -0.946594
H -2.275148 -1.488057 0.769709
H -3.598077 0.622295 1.299792
H -3.696070 0.976083 -0.436250
H 4.068718 1.301292 -0.530515
H 4.115118 0.757762 1.159767
H 5.432092 -1.296958 0.454685
H 5.400729 -0.733334 -1.228907
H 6.693433 0.792746 1.133992
H 6.661904 1.361123 -0.548284
H 7.984507 -0.676639 -1.265387
H 8.008008 -1.255059 0.413473
H 9.253589 1.405457 -0.565372
H 9.275117 0.827263 1.113697
H 10.565200 -0.638503 -1.285725
H 10.585366 -1.217355 0.391678
H 11.890316 0.855560 1.096240
H 11.873144 1.434980 -0.592669
H 12.761666 -0.057119 -0.169802


