%chk=000252537.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252537

0 1
O 3.401683 2.536705 -0.749854
N -4.744763 -0.189693 0.043605
C 1.654802 0.803667 -0.485743
C 3.098260 1.149338 -0.978348
C 1.804208 -0.430088 0.447334
C 0.695100 0.557758 -1.657813
C 4.020639 0.340299 -0.100055
C 3.279091 -0.567547 0.693815
C -0.718954 0.355803 -1.188192
C 5.402990 0.400624 -0.016266
C 3.928175 -1.434502 1.562753
C 6.058620 -0.475556 0.867052
C 5.330997 -1.380585 1.640825
C -1.294212 -0.922442 -1.170581
C -1.489916 1.447257 -0.759180
C -3.383472 -0.017252 -0.301072
C -2.602747 -1.115829 -0.735333
C -2.797695 1.273203 -0.318383
C -5.466362 0.909886 0.737183
C -5.245825 -1.557732 0.367614
C -5.075596 1.078710 2.206372
C -5.932601 -2.158603 -0.860259
H 1.284731 1.663780 0.122030
H 3.255941 0.937192 -2.056349
H 1.389872 -1.344506 -0.016206
H 1.239688 -0.286176 1.385919
H 1.035841 -0.315789 -2.250626
H 0.733024 1.415745 -2.360497
H 5.965205 1.118300 -0.610569
H 3.370310 -2.136373 2.175497
H 2.781320 3.104432 -1.244360
H 7.142990 -0.440974 0.947175
H 5.852497 -2.053718 2.319470
H -0.714320 -1.782774 -1.503883
H -1.060388 2.448565 -0.767682
H -3.019476 -2.119563 -0.744933
H -3.369205 2.140882 0.002008
H -5.281439 1.858289 0.179967
H -6.558101 0.709479 0.647308
H -4.416938 -2.219660 0.706917
H -5.963669 -1.511600 1.216128
H -3.997726 1.255716 2.318756
H -5.316672 0.190969 2.800966
H -5.596747 1.929355 2.658848
H -5.251076 -2.204408 -1.719905
H -6.789313 -1.551313 -1.177035
H -6.291571 -3.172370 -0.658019


%chk=000252537-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252537

0 1
O 3.446645 2.384150 -1.293718
N -4.705308 -0.259792 0.331285
C 1.751482 0.598919 -0.632435
C 3.183953 0.941838 -1.153259
C 1.942686 -0.704279 0.208176
C 0.684618 0.498511 -1.749945
C 4.095925 0.345408 -0.097639
C 3.388878 -0.607904 0.677201
C -0.731333 0.298217 -1.227434
C 5.456166 0.616200 0.139165
C 4.048364 -1.311453 1.705020
C 6.117429 -0.086172 1.176595
C 5.418582 -1.045197 1.950729
C -1.409631 -0.938228 -1.353939
C -1.424196 1.344429 -0.566148
C -3.408732 -0.079148 -0.177938
C -2.712095 -1.132440 -0.851693
C -2.721307 1.171358 -0.049106
C -5.465842 0.858432 0.919592
C -5.368402 -1.576175 0.302094
C -5.171653 1.093089 2.421321
C -6.121217 -1.866968 -1.019212
H 1.476569 1.418333 0.061998
H 3.353834 0.442459 -2.137588
H 1.797081 -1.598495 -0.433948
H 1.215907 -0.785930 1.035018
H 0.957658 -0.336049 -2.427193
H 0.726623 1.427281 -2.360439
H 5.979107 1.372620 -0.455146
H 3.511064 -2.047337 2.314989
H 2.913739 2.731983 -2.053220
H 7.174001 0.115667 1.386776
H 5.941527 -1.579794 2.752388
H -0.914290 -1.772098 -1.868501
H -0.936897 2.321341 -0.445912
H -3.189836 -2.104686 -1.003612
H -3.194401 2.012424 0.465887
H -5.269415 1.783171 0.344667
H -6.543442 0.642278 0.788557
H -4.623677 -2.370390 0.498878
H -6.084265 -1.614432 1.145407
H -4.104161 1.321175 2.585423
H -5.419417 0.193569 3.013800
H -5.772449 1.937044 2.809660
H -5.432120 -1.844354 -1.881245
H -6.906788 -1.109799 -1.195301
H -6.603764 -2.861877 -0.983659


