%chk=000206904.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206904

0 1
O -1.936941 0.988973 0.859720
O 4.464394 -1.424718 -0.504682
O -2.461581 2.472922 -0.789042
N -2.511901 -2.167700 -0.227833
N 1.633270 -1.428241 -0.044581
C -0.661195 -0.989126 1.023093
C -0.873103 0.261338 0.100045
C -2.042148 -1.715080 1.124129
C -1.439639 -0.172120 -1.255283
C -2.748426 -0.982530 -1.132854
C 0.348571 -2.021222 0.440959
C -0.262070 -0.565867 2.442389
C 0.295770 1.225869 -0.004627
C -3.180840 -1.457196 -2.526771
C -3.746062 -2.995408 -0.067959
C 2.262861 -2.338583 -1.062651
C 2.602649 -1.190523 1.074624
C 1.142265 1.225775 -1.123592
C 0.525721 2.158334 1.020104
C 3.546913 -1.677071 -1.587493
C 3.887693 -0.571012 0.506527
C -2.606870 2.064560 0.337379
C 2.194771 2.141996 -1.215738
C 1.580541 3.069596 0.929921
C 2.417019 3.065349 -0.190276
C -3.525337 2.594302 1.390810
H -1.938377 -2.611098 1.770839
H -2.766887 -1.036286 1.626152
H -0.673320 -0.773065 -1.787669
H -1.626865 0.723940 -1.888261
H -3.544390 -0.309752 -0.715757
H -0.148282 -2.526530 -0.426016
H 0.503507 -2.817919 1.200568
H -0.244060 -1.413857 3.132944
H 0.743473 -0.112651 2.451048
H -0.960555 0.179841 2.843710
H -3.160820 -0.630647 -3.246533
H -2.516322 -2.243992 -2.904904
H -4.199008 -1.858906 -2.524207
H -3.996375 -3.453751 -1.038508
H -4.626606 -2.444873 0.293898
H -3.543505 -3.823820 0.629005
H 1.545170 -2.481839 -1.897868
H 2.500812 -3.344453 -0.654726
H 2.844830 -2.114088 1.641290
H 2.129119 -0.471760 1.788768
H 0.998040 0.494938 -1.919507
H -0.133645 2.179130 1.887874
H 4.127290 -2.351484 -2.240276
H 3.334392 -0.725291 -2.105946
H 3.699403 0.426652 0.068214
H 4.693475 -0.516685 1.258017
H 2.840412 2.136446 -2.091627
H 1.745968 3.787965 1.729692
H 3.233604 3.779921 -0.265749
H -3.225654 3.613061 1.682096
H -3.530780 1.972658 2.298044
H -4.556066 2.656774 1.010976


%chk=000206904-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206904

0 1
O -2.031491 1.027039 0.893849
O 4.515351 -1.740044 -0.657099
O -2.393590 2.629525 -0.787973
N -2.465874 -2.168718 -0.229114
N 1.644878 -1.522828 -0.108441
C -0.653271 -0.953464 1.091932
C -0.878301 0.314263 0.164431
C -2.008431 -1.740857 1.116555
C -1.380775 -0.165489 -1.215945
C -2.674114 -1.010430 -1.148329
C 0.383112 -1.985191 0.516903
C -0.335226 -0.579740 2.561773
C 0.268434 1.337768 0.088068
C -3.052715 -1.471412 -2.570627
C -3.634745 -3.066725 -0.124216
C 2.216069 -2.614291 -0.950065
C 2.664060 -1.052964 0.868261
C 1.064307 1.480550 -1.075171
C 0.519972 2.211231 1.180154
C 3.505460 -2.152499 -1.643443
C 3.964732 -0.643265 0.158044
C -2.647247 2.150083 0.339138
C 2.076043 2.461912 -1.147992
C 1.539314 3.186212 1.115927
C 2.323447 3.319438 -0.051778
C -3.656559 2.713107 1.322971
H -1.855847 -2.656247 1.722275
H -2.771097 -1.116204 1.638653
H -0.585140 -0.783155 -1.670626
H -1.556749 0.707697 -1.864351
H -3.502696 -0.361123 -0.760816
H -0.162718 -2.561600 -0.252920
H 0.600446 -2.697773 1.357332
H -0.279590 -1.501938 3.170308
H 0.626787 -0.055162 2.669013
H -1.127377 0.062289 2.984304
H -3.056019 -0.604365 -3.255250
H -2.316449 -2.208213 -2.942159
H -4.056516 -1.928545 -2.614095
H -3.868853 -3.514952 -1.103375
H -4.554497 -2.550842 0.252234
H -3.398574 -3.890112 0.573518
H 1.469124 -2.903149 -1.714225
H 2.445081 -3.522719 -0.336146
H 2.886442 -1.851504 1.621938
H 2.276029 -0.170512 1.404311
H 0.903735 0.819361 -1.929588
H -0.103516 2.147726 2.077364
H 3.964440 -2.976551 -2.214841
H 3.280932 -1.304446 -2.327207
H 3.773566 0.239319 -0.486345
H 4.749253 -0.399603 0.893464
H 2.668523 2.560800 -2.064729
H 1.710278 3.848913 1.972058
H 3.107218 4.083017 -0.110412
H -3.127794 3.320729 2.080681
H -4.187832 1.905695 1.852350
H -4.369130 3.361155 0.791371


