%chk=000106630.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000106630

1 1
O 6.045121 -0.232135 2.237930
N 2.675013 0.451015 -0.107944
N 3.868074 0.768781 0.532060
N -6.088417 0.709569 -0.020264
N 0.302122 0.616469 0.255845
N -0.617448 1.104711 1.007638
C 2.596472 -0.176089 -1.451547
C 5.207206 0.360348 0.053363
C 1.617273 0.826375 0.732749
C 3.573720 1.272521 1.795715
C 2.187777 1.344988 1.928279
C 3.161045 -1.573570 -1.467224
C 5.780466 -0.763110 0.941665
C -4.744822 0.787609 0.201527
C -6.663090 -0.006829 -1.198218
C -7.086527 1.335051 0.898736
C 4.088692 -1.932339 -2.456534
C 2.734809 -2.521627 -0.526467
C -4.221347 1.473802 1.354711
C -3.804427 0.185488 -0.711097
C -1.938322 0.951429 0.664020
C -6.780077 0.918436 -2.403480
C -7.476075 0.381475 2.021654
C -2.872566 1.552639 1.575484
C -2.457495 0.266048 -0.484276
C 4.592587 -3.235213 -2.495484
C 3.249157 -3.820630 -0.566703
C 4.178268 -4.178520 -1.548874
H 3.084768 0.490032 -2.202690
H 1.503649 -0.209095 -1.733880
H 5.864909 1.265715 0.097597
H 5.178813 0.040105 -1.014066
H 4.362955 1.532296 2.499865
H 1.623726 1.717360 2.771405
H 6.688073 -1.202076 0.489594
H 5.037439 -1.569443 1.125020
H -7.663459 -0.411695 -0.915872
H -6.033169 -0.894593 -1.443804
H -6.672261 2.284124 1.315107
H -7.983390 1.628929 0.304271
H 4.404975 -1.212858 -3.211045
H 1.993176 -2.255319 0.228009
H -4.911074 1.936398 2.061702
H -4.175457 -0.339431 -1.591605
H -7.441666 1.773184 -2.211022
H -5.808965 1.329896 -2.709348
H -7.193372 0.383361 -3.269958
H -7.941483 -0.538980 1.646084
H -6.613110 0.077789 2.629389
H -8.200692 0.851779 2.701402
H -2.480633 2.077072 2.454288
H -1.747989 -0.194299 -1.179259
H 5.305297 -3.519805 -3.271776
H 2.915928 -4.560090 0.164065
H 4.572355 -5.196034 -1.583408
H 6.973871 0.082088 2.312070


%chk=000106630-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106630

1 1
O 6.110592 -0.155691 2.154318
N 2.704183 0.520098 -0.091884
N 3.906147 0.832121 0.554354
N -6.044127 0.667293 -0.036054
N 0.359850 0.717325 0.263610
N -0.554044 1.175600 1.130404
C 2.597253 -0.127393 -1.415552
C 5.245065 0.499200 0.027030
C 1.652372 0.930577 0.720806
C 3.603023 1.420639 1.762079
C 2.214618 1.506088 1.900040
C 3.081092 -1.574100 -1.438496
C 5.910898 -0.653978 0.790167
C -4.696688 0.776635 0.227222
C -6.566097 -0.046317 -1.232556
C -7.073960 1.258182 0.860532
C 3.949226 -2.015990 -2.466087
C 2.632716 -2.497127 -0.459681
C -4.214766 1.395733 1.440169
C -3.707881 0.274852 -0.706991
C -1.878858 1.004849 0.762059
C -6.667238 0.858980 -2.479880
C -7.485034 0.315819 2.013162
C -2.851339 1.503441 1.690627
C -2.348760 0.384822 -0.447636
C 4.366726 -3.366131 -2.516961
C 3.054592 -3.843687 -0.506889
C 3.923588 -4.281316 -1.534943
H 3.124061 0.485041 -2.170344
H 1.514354 -0.067692 -1.633079
H 5.873739 1.401441 0.123442
H 5.162659 0.245451 -1.039858
H 4.409529 1.705541 2.432435
H 1.648879 1.919911 2.727591
H 6.876872 -0.877166 0.292880
H 5.272777 -1.559250 0.768159
H -7.567366 -0.431946 -0.970090
H -5.938618 -0.930861 -1.437269
H -6.709087 2.223397 1.252227
H -7.954913 1.490143 0.235848
H 4.289056 -1.313734 -3.238520
H 1.949090 -2.166662 0.331626
H -4.918311 1.774074 2.184473
H -4.028187 -0.186124 -1.644406
H -7.331616 1.721082 -2.292912
H -5.679177 1.249885 -2.778378
H -7.084246 0.286784 -3.327541
H -7.891752 -0.634513 1.624574
H -6.628853 0.077872 2.667729
H -8.267908 0.794133 2.627985
H -2.486404 1.968773 2.611862
H -1.614035 0.007145 -1.164858
H 5.031823 -3.701846 -3.319457
H 2.701051 -4.552900 0.249080
H 4.246105 -5.327018 -1.573691
H 6.527730 -0.848382 2.722921


