%chk=000283297.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283297

0 1
O -1.485716 -2.976074 -0.937001
O -3.316144 -0.935624 1.489307
O -2.124350 2.857298 -1.068255
O 0.391858 -4.178808 -1.314694
O -3.847622 1.132268 2.240212
O -0.276232 4.166472 -1.023670
N 3.204203 -1.758759 0.192858
C -0.486879 -1.162769 0.286919
C 0.909165 -0.903271 0.245725
C 1.374767 0.433412 0.231247
C -1.401041 -0.107633 0.262101
C -0.928774 1.233083 0.265412
C 0.432988 1.488665 0.246995
C 2.808858 0.682667 0.206957
C -0.988729 -2.581931 0.377460
C -2.877711 -0.392707 0.204163
C -1.871299 2.407559 0.295878
C 3.684942 -0.432637 0.202467
C 1.911752 -1.967548 0.204849
C 3.368707 1.985475 0.189510
C 5.093139 -0.240979 0.193782
C 4.739724 2.159273 0.178710
C 5.606593 1.040617 0.183238
C -0.668650 -3.768602 -1.722507
C -3.761736 -0.055173 2.452434
C -1.232423 3.746094 -1.632619
C -1.333682 -3.995225 -3.032187
C -4.100039 -0.816840 3.683777
C -1.674100 4.053036 -3.019693
H 0.789569 2.528070 0.229020
H -1.890048 -2.677374 1.019115
H -0.218750 -3.301824 0.720349
H -3.121625 -1.223364 -0.491273
H -3.489639 0.495590 -0.047559
H -2.898170 2.158625 0.650914
H -1.475542 3.250198 0.895057
H 1.567807 -3.019753 0.158726
H 2.703064 2.851898 0.181897
H 5.741293 -1.119029 0.193393
H 5.166682 3.161354 0.165799
H 6.684070 1.203016 0.176528
H -2.349221 -3.570195 -3.072207
H -1.406311 -5.072527 -3.253295
H -0.748307 -3.538010 -3.847558
H -3.405672 -0.561653 4.501646
H -4.051707 -1.907510 3.535760
H -5.114764 -0.565949 4.033305
H -0.918249 3.722238 -3.750338
H -2.626525 3.562758 -3.277951
H -1.803924 5.138503 -3.157005


%chk=000283297-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000283297

0 1
O -1.310145 -2.796509 -1.273021
O -3.406348 -0.800214 1.447963
O -2.359837 2.912382 -0.881114
O 0.124046 -4.631195 -1.057118
O -3.718749 1.257656 2.503534
O -0.520063 4.197452 -1.530683
N 3.201857 -1.815739 0.149310
C -0.487991 -1.022840 0.235150
C 0.937877 -0.831754 0.235464
C 1.484148 0.499501 0.306199
C -1.355882 0.094697 0.298378
C -0.805384 1.420360 0.366044
C 0.585274 1.598950 0.369121
C 2.936888 0.662683 0.304400
C -1.077048 -2.420092 0.169436
C -2.861011 -0.105987 0.220543
C -1.688133 2.650211 0.443710
C 3.749105 -0.525023 0.233974
C 1.875836 -1.942455 0.146851
C 3.594768 1.927743 0.369734
C 5.170892 -0.422709 0.238943
C 4.994231 2.011626 0.372014
C 5.790640 0.831073 0.308409
C -0.639122 -3.929900 -1.758558
C -3.778576 0.007046 2.526978
C -1.636002 3.695003 -1.793078
C -0.967270 -4.144477 -3.219162
C -4.235294 -0.840538 3.693210
C -2.389099 3.814564 -3.099835
H 0.967695 2.622955 0.396910
H -2.068902 -2.465696 0.639313
H -0.429352 -3.186002 0.623897
H -3.131533 -0.801712 -0.588375
H -3.401767 0.841216 0.085053
H -2.527980 2.522030 1.142998
H -1.093910 3.540032 0.706497
H 1.503979 -2.969321 0.056372
H 3.010240 2.851915 0.415267
H 5.743172 -1.353650 0.184077
H 5.478924 2.992768 0.421677
H 6.883205 0.907948 0.311397
H -2.058268 -4.122530 -3.377486
H -0.553737 -5.106718 -3.553077
H -0.528527 -3.329470 -3.821827
H -3.352008 -1.222817 4.236901
H -4.815691 -1.709138 3.344322
H -4.834355 -0.228232 4.382971
H -2.254853 2.887512 -3.686552
H -3.468214 3.943467 -2.919351
H -1.992129 4.660328 -3.680080


