%chk=000239310.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239310

0 1
O 0.286116 0.987324 -1.006730
N -1.358420 -0.688291 -0.855105
N 0.729889 -0.918845 0.299645
C -2.011399 -1.810814 -0.118054
C -3.163613 -2.357643 -0.986244
C -2.511483 -1.389942 1.281346
C -0.522280 2.179598 -0.770908
C 2.090220 -0.438207 0.625216
C -4.386599 -1.432882 -1.019521
C -3.723639 -0.454963 1.222674
C -4.860046 -1.069418 0.394016
C 0.285749 3.283666 -1.466552
C -0.733941 2.427737 0.728363
C 2.706739 -1.427904 1.639091
C 2.990270 -0.281082 -0.622288
C 1.571561 3.631288 -0.705783
C 0.577015 2.771768 1.445110
C 3.083419 -2.765638 0.989096
C 3.356446 -1.631383 -1.247792
C 1.287532 3.950155 0.767849
C 4.010395 -2.562382 -0.217130
C -0.092347 -0.235273 -0.426608
H -1.233097 -2.615148 0.008261
H -2.798945 -2.538713 -2.016993
H -3.456736 -3.349039 -0.589260
H -1.683631 -0.917996 1.845605
H -2.771543 -2.303176 1.851116
H -1.496015 2.019610 -1.285230
H 2.004643 0.580709 1.120108
H -5.207567 -1.924994 -1.575489
H -4.150895 -0.512861 -1.586950
H -4.079960 -0.241535 2.248472
H -3.430997 0.521973 0.794841
H -5.711529 -0.366366 0.338443
H -5.244126 -1.974836 0.902753
H -0.351339 4.181430 -1.575141
H 0.543804 2.948259 -2.492020
H -1.196439 1.541094 1.203215
H -1.457857 3.256487 0.854626
H 1.990837 -1.607562 2.463840
H 3.601624 -0.961309 2.090054
H 2.471589 0.353677 -1.370367
H 3.908864 0.261724 -0.334300
H 2.269741 2.770586 -0.770989
H 2.078397 4.484017 -1.192513
H 0.381568 2.997077 2.508370
H 1.246973 1.874666 1.429541
H 2.155805 -3.278105 0.660415
H 3.562352 -3.426019 1.733282
H 4.031356 -1.478669 -2.108725
H 2.438992 -2.108355 -1.648666
H 0.669398 4.864024 0.847198
H 2.233982 4.173990 1.294314
H 4.976849 -2.139896 0.114689
H 4.242602 -3.537284 -0.683015
H -1.998784 0.036370 -1.177478


%chk=000239310-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239310

0 1
O 0.367199 1.261347 -0.963103
N -1.333621 -0.394529 -0.801506
N 0.830711 -0.883906 0.000174
C -1.855885 -1.747672 -0.490803
C -3.129611 -2.011315 -1.330351
C -2.157312 -1.902914 1.024351
C -0.579713 2.407985 -0.751911
C 2.214578 -0.475168 0.334152
C -4.336534 -1.149601 -0.879121
C -3.354644 -1.035635 1.474510
C -4.618156 -1.335418 0.631678
C 0.078386 3.608882 -1.453138
C -0.817404 2.658948 0.752998
C 2.663596 -1.231779 1.611059
C 3.177386 -0.803861 -0.844618
C 1.355876 4.085561 -0.722132
C 0.457363 3.154700 1.476027
C 2.774380 -2.755275 1.368063
C 3.298077 -2.325877 -1.091606
C 1.066297 4.388731 0.767778
C 3.734876 -3.068540 0.194823
C -0.007429 -0.054049 -0.541680
H -1.067912 -2.478881 -0.761695
H -2.913863 -1.853964 -2.406672
H -3.393563 -3.080684 -1.213076
H -1.243512 -1.654451 1.593131
H -2.381385 -2.972353 1.218877
H -1.545091 2.176057 -1.249663
H 2.270849 0.620512 0.517736
H -5.229904 -1.420126 -1.474606
H -4.139320 -0.075630 -1.080073
H -3.561686 -1.205611 2.548863
H -3.088891 0.035552 1.363802
H -5.456847 -0.684482 0.946863
H -4.938170 -2.382762 0.813842
H -0.663596 4.433472 -1.479024
H 0.305772 3.334861 -2.499951
H -1.203725 1.735170 1.224495
H -1.615916 3.425010 0.841470
H 1.948512 -1.024511 2.430445
H 3.651141 -0.832453 1.924358
H 2.825414 -0.284228 -1.756011
H 4.177969 -0.391451 -0.595669
H 2.125015 3.292901 -0.793073
H 1.761471 4.982937 -1.227531
H 0.217609 3.391805 2.530361
H 1.205338 2.338386 1.490676
H 1.766320 -3.143799 1.125886
H 3.115364 -3.264042 2.291277
H 4.017741 -2.519392 -1.911559
H 2.313245 -2.713758 -1.417569
H 0.357867 5.241075 0.839581
H 1.995723 4.700775 1.281787
H 4.764512 -2.753341 0.468737
H 3.772125 -4.160674 0.011859
H -1.825520 0.148164 -1.511823


