%chk=000241056.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241056

0 1
O -0.561073 2.555582 -0.993582
N -1.727705 -1.038852 -1.347459
C -2.916991 -0.454068 -0.655308
C -3.848054 -1.630877 -0.281724
C -2.567876 0.381045 0.597633
C -5.117838 -1.119335 0.408855
C -3.839091 0.877761 1.296259
C -4.777796 -0.284116 1.651225
C -0.832083 -0.044152 -2.000936
C 3.589879 -1.169679 0.191532
C 0.352298 0.379470 -1.166317
C 2.493250 -0.139543 -0.089737
C 1.378009 -0.517099 -0.861844
C 2.953781 -2.507433 0.622421
C 4.540458 -0.711149 1.314602
C 4.399360 -1.366088 -1.106100
C 0.474508 1.697897 -0.680613
C 2.580522 1.182349 0.363006
C 1.575355 2.111490 0.075085
H -3.445488 0.205528 -1.391324
H -3.320367 -2.343058 0.379063
H -4.108668 -2.199277 -1.194971
H -1.939052 1.245346 0.304436
H -1.959638 -0.217455 1.299014
H -5.759806 -1.974023 0.692054
H -5.712614 -0.512055 -0.300279
H -4.367213 1.598023 0.641976
H -3.568925 1.436632 2.211346
H -5.704689 0.105391 2.110410
H -4.302341 -0.928199 2.415297
H -1.190125 -1.625696 -0.701861
H -1.414906 0.849422 -2.325652
H -0.466170 -0.525884 -2.940436
H 1.309685 -1.539882 -1.240252
H 3.719189 -3.241522 0.894282
H 2.301176 -2.372823 1.491579
H 2.352307 -2.952949 -0.176636
H 3.997771 -0.524502 2.247323
H 5.295444 -1.476321 1.526225
H 5.080318 0.202658 1.046295
H 5.206168 -2.092245 -0.967189
H 3.769129 -1.727859 -1.925033
H 4.852579 -0.425633 -1.437350
H 3.439171 1.513736 0.947436
H 1.654795 3.132142 0.434199
H -0.393642 3.468802 -0.657751


%chk=000241056-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241056

0 1
O -0.590222 2.679643 -1.138690
N -1.789581 -0.939513 -1.519148
C -2.884161 -0.397035 -0.678803
C -3.980382 -1.482999 -0.538792
C -2.456862 0.116406 0.728869
C -5.189389 -0.996455 0.295821
C -3.669559 0.611671 1.555061
C -4.748083 -0.488353 1.688796
C -0.812462 -0.014532 -2.140394
C 3.579072 -1.123432 0.259968
C 0.356561 0.457561 -1.263198
C 2.496460 -0.074628 -0.092600
C 1.393226 -0.436371 -0.912055
C 2.920257 -2.306804 1.031373
C 4.702615 -0.531579 1.149801
C 4.230003 -1.665352 -1.048553
C 0.449153 1.789149 -0.780737
C 2.544039 1.264199 0.368988
C 1.534240 2.191418 0.027361
H -3.316698 0.461060 -1.236024
H -3.534747 -2.374807 -0.045763
H -4.297390 -1.798775 -1.549924
H -1.713660 0.926130 0.621617
H -1.958413 -0.717258 1.269549
H -5.930577 -1.813054 0.398838
H -5.697355 -0.171211 -0.245992
H -4.114935 1.496607 1.053186
H -3.335382 0.948502 2.556219
H -5.621434 -0.106577 2.253281
H -4.332424 -1.336643 2.272004
H -1.340593 -1.757622 -1.084402
H -1.371433 0.860901 -2.511100
H -0.385674 -0.528574 -3.025279
H 1.330072 -1.460655 -1.304660
H 3.680327 -3.070152 1.284332
H 2.455703 -1.953129 1.970004
H 2.134576 -2.797374 0.428824
H 4.308463 -0.159714 2.113792
H 5.449141 -1.315546 1.374116
H 5.231244 0.298497 0.645183
H 4.999260 -2.423472 -0.807752
H 3.482662 -2.139682 -1.709568
H 4.712517 -0.848285 -1.615444
H 3.371182 1.603172 0.998854
H 1.596871 3.225330 0.394013
H -0.413228 3.580838 -0.771773


