%chk=000231445.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231445

0 1
O -0.088125 -1.060558 1.724562
N -0.095464 1.687372 1.002423
C -0.327170 -1.182180 0.321296
C 0.551717 -0.171944 -0.502919
C 0.094318 -2.637046 0.006697
C -1.803685 -0.938899 0.009070
C 2.038827 -0.373021 -0.295731
C 0.219799 1.288280 -0.260465
C -0.824582 -3.659419 0.665483
C -2.268134 -0.990343 -1.313617
C -2.711933 -0.691527 1.046772
C 2.610897 -0.321636 0.983403
C 2.859410 -0.601498 -1.411956
C 0.264967 2.203290 -1.335463
C -3.620609 -0.778289 -1.593707
C -4.064275 -0.478330 0.765011
C 3.987304 -0.497534 1.144052
C 4.236137 -0.775625 -1.246121
C -4.521141 -0.518322 -0.555620
C -0.024724 3.545813 -1.093521
C 4.803258 -0.723223 0.030825
C -0.378394 2.998842 1.222489
C -0.353535 3.959747 0.202491
H 0.315204 -0.389349 -1.582559
H 1.131911 -2.781481 0.379271
H 0.126136 -2.795500 -1.086037
H -0.907579 -3.462315 1.744583
H -1.838758 -3.625148 0.250506
H -0.441922 -4.677058 0.539779
H -0.208296 -0.119657 2.028920
H -1.579208 -1.202240 -2.128766
H -2.358197 -0.675799 2.079614
H 1.969567 -0.160420 1.854454
H 2.430524 -0.644807 -2.410260
H 0.527691 1.866338 -2.334953
H -3.973842 -0.817898 -2.622171
H -4.762202 -0.283865 1.577268
H 4.423862 -0.459913 2.140841
H 4.867674 -0.952883 -2.114588
H -5.573378 -0.351571 -0.774971
H 0.004745 4.269092 -1.908872
H 5.874947 -0.858849 0.158141
H -0.629050 3.266228 2.255626
H -0.584193 4.999943 0.414819


%chk=000231445-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231445

0 1
O -0.192675 -0.891068 1.781989
N -0.004769 1.667634 1.157215
C -0.358170 -1.133579 0.348766
C 0.557881 -0.119571 -0.476738
C 0.088046 -2.599037 0.099345
C -1.834069 -0.930165 -0.083062
C 2.064596 -0.370961 -0.328304
C 0.213535 1.337288 -0.158346
C -0.759176 -3.628917 0.873273
C -2.234102 -1.103642 -1.434849
C -2.824329 -0.605275 0.875101
C 2.752316 -0.146184 0.893688
C 2.803577 -0.838983 -1.445182
C 0.142858 2.322020 -1.174082
C -3.582874 -0.939997 -1.819832
C -4.175371 -0.438410 0.493708
C 4.140015 -0.389954 0.989834
C 4.192461 -1.082541 -1.351050
C -4.561359 -0.601107 -0.856031
C -0.145139 3.659335 -0.830008
C 4.867125 -0.858014 -0.129692
C -0.288653 2.958472 1.485915
C -0.363734 3.990530 0.527415
H 0.312301 -0.276576 -1.543115
H 1.144191 -2.681931 0.412696
H 0.049841 -2.812354 -0.988019
H -0.748830 -3.389412 1.950083
H -1.809804 -3.633683 0.531416
H -0.349506 -4.646581 0.736222
H -0.160848 0.127361 1.882609
H -1.496462 -1.385763 -2.197307
H -2.519442 -0.506119 1.921444
H 2.199595 0.206085 1.768871
H 2.286003 -1.020737 -2.396115
H 0.313180 2.035431 -2.216644
H -3.871879 -1.081217 -2.867944
H -4.927189 -0.188385 1.251523
H 4.655349 -0.216721 1.941617
H 4.744161 -1.446064 -2.225551
H -5.608705 -0.474104 -1.152990
H -0.202390 4.430238 -1.605781
H 5.944151 -1.044600 -0.051079
H -0.460958 3.158783 2.548826
H -0.590251 5.015269 0.836266


