%chk=000239103.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239103

0 1
O -7.936890 0.337371 -0.095431
N -4.377926 0.151976 -0.221587
C -4.738134 -1.310537 -0.187369
C -5.588321 0.945783 0.181921
C -6.242646 -1.335007 -0.544520
C -3.148941 0.546703 0.526687
C -6.775919 0.025146 -0.154659
C -1.908726 -0.026947 -0.180029
C -4.484779 -2.031840 1.141231
C -0.619318 0.493426 0.466764
C -5.664171 2.238679 -0.625289
C 0.623077 -0.082501 -0.226353
C 1.915752 0.436699 0.417497
C 3.157726 -0.139532 -0.275867
C 4.450777 0.379037 0.367842
C 5.692679 -0.197249 -0.325598
C 6.985957 0.321009 0.317956
C 8.227522 -0.255318 -0.375563
C 9.522106 0.262240 0.267208
C 10.761201 -0.308295 -0.419282
H -4.132797 -1.796509 -0.993003
H -5.618397 1.177139 1.276897
H -6.796041 -2.147693 -0.044116
H -6.395863 -1.497139 -1.629272
H -3.094552 1.659603 0.517046
H -3.164908 0.240174 1.594209
H -1.927286 -1.132668 -0.156047
H -1.938654 0.247449 -1.254300
H -3.419824 -2.041117 1.401307
H -4.808074 -3.077690 1.089096
H -5.022720 -1.565941 1.973580
H -0.602619 0.234363 1.542909
H -0.593440 1.599689 0.421420
H -6.653761 2.704283 -0.525323
H -5.484244 2.053631 -1.693714
H -4.910722 2.962713 -0.297186
H 0.599814 -1.188506 -0.184741
H 0.607712 0.178273 -1.302527
H 1.931634 0.177363 1.493597
H 1.940320 1.542731 0.373775
H 3.133808 -1.245524 -0.233437
H 3.142822 0.120741 -1.351913
H 4.475394 1.485029 0.324769
H 4.466303 0.119182 1.443844
H 5.668570 -1.303231 -0.283082
H 5.677784 0.062930 -1.401601
H 7.001235 0.060939 1.393910
H 7.010454 1.426985 0.275052
H 8.204658 -1.361192 -0.333721
H 8.213908 0.004109 -1.451576
H 9.538115 0.001527 1.343552
H 9.547370 1.368709 0.223922
H 11.679637 0.066581 0.045945
H 10.786991 -1.402361 -0.361363
H 10.796148 -0.036019 -1.480267


%chk=000239103-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239103

0 1
O -8.039134 0.280745 -0.347120
N -4.469254 0.133685 -0.182646
C -4.787765 -1.333737 -0.169140
C -5.693134 0.879470 0.206111
C -6.207963 -1.348896 -0.782403
C -3.215520 0.568915 0.463688
C -6.825322 -0.027414 -0.317493
C -1.959864 -0.062627 -0.172561
C -4.761029 -2.008196 1.230586
C -0.650490 0.505369 0.419584
C -5.777926 2.311109 -0.356982
C 0.617461 -0.123703 -0.200732
C 1.931029 0.446045 0.380357
C 3.198333 -0.176378 -0.247898
C 4.513095 0.394066 0.329982
C 5.779978 -0.223989 -0.303560
C 7.095217 0.347014 0.273082
C 8.362263 -0.267993 -0.363183
C 9.677444 0.303749 0.214114
C 10.938048 -0.314837 -0.428253
H -4.068177 -1.856024 -0.825080
H -5.825605 0.938661 1.320841
H -6.827713 -2.211778 -0.486530
H -6.158292 -1.328075 -1.888396
H -3.148052 1.667932 0.349982
H -3.213201 0.364744 1.566149
H -1.970560 -1.162571 -0.031357
H -1.990980 0.119214 -1.264863
H -3.765429 -1.924913 1.702886
H -4.995854 -3.084320 1.135650
H -5.503829 -1.559333 1.916557
H -0.638769 0.344209 1.518211
H -0.624617 1.604609 0.266110
H -6.795903 2.707469 -0.194642
H -5.564435 2.305530 -1.439949
H -5.059342 2.986470 0.139939
H 0.595155 -1.222880 -0.045623
H 0.603790 0.034923 -1.299284
H 1.947816 0.282311 1.478374
H 1.950837 1.545951 0.230395
H 3.179528 -1.276354 -0.097930
H 3.180280 -0.012893 -1.345914
H 4.530280 1.494492 0.183191
H 4.533754 0.227349 1.427505
H 5.763418 -1.324470 -0.157011
H 5.759014 -0.057225 -1.401067
H 7.117695 0.178249 1.370310
H 7.110685 1.447812 0.128455
H 8.348683 -1.368888 -0.219104
H 8.341564 -0.098919 -1.460390
H 9.697575 0.133649 1.310105
H 9.689510 1.403685 0.070727
H 11.863867 0.110300 0.001510
H 10.964932 -1.410082 -0.272670
H 10.956709 -0.131837 -1.519422


